CR 830

Molecular Formula: C31H45N3O8


InChI: InChI=1/C29H43N3O4.C2H2O4/c1-5-18-32(19-6-2)28(33)27(30-29(34)36-23-25-12-10-9-11-13-25)22-24-14-16-26(17-15-24)35-21-20-31(7-3)8-4;3-1(4)2(5)6/h9-17,27H,5-8,18-23H2,1-4H3,(H,30,34);(H,3,4)(H,5,6)/t27-;/m0./s1/fC29H44N3O4.C2HO4/h30-31H;3H/q+1;-1

InChIKey: InChIKey=NMMRDLUHILKXKV-ONJUZOOXDK
SMILES: CCCN(CCC)C(=O)C(CC1=CC=C(C=C1)OCC[NH+](CC)CC)NC(=O)OCC2=CC=CC=C2.C(=O)(C(=O)[O-])O

Names:
    Carbamic acid, (1-((4-(2-diethylamino)ethoxy)phenyl)methyl)-2-(dipropylamino)-2-oxoethyl)-, benzyl ester, oxalate, (S)-
    CARBAMIC ACID, (1-((4-(2-(DIETHYLAMINO)ETHOXY)PHENYL)METHYL)-2-(DIPROPYLAMINO)-2
    CR 830
    O-(2-Diethylaminoethyl)-N-carbobenzoxy-L-tyrosyl-di-n-propylamide oxalate
    2-[4-[(2S)-2-(dipropylcarbamoyl)-2-phenylmethoxycarbonylamino-ethyl]phenoxy]ethyl-diethyl-azanium; 2-hydroxy-2-oxo-acetate
    57228-42-9

Registries:
    PubChem CID 42228
    PubChem ID 182827