ZINC07864609
Molecular Formula:
C
16
H
22
N
2
O
7
S
InChI:
InChI=1/C16H22N2O7S/c1-4-12(5-2)17-15(19)10-25-16(20)11(3)26(23,24)14-8-6-13(7-9-14)18(21)22/h6-9,11-12H,4-5,10H2,1-3H3,(H,17,19)/t11-/m0/s1/f/h17H
InChIKey:
InChIKey=OHIZAHIVYDQZTR-RVLNTAOFDK
SMILES:
CCC(CC)NC(=O)COC(=O)C(C)S(=O)(=O)C1=CC=C(C=C1)[N+](=O)[O-]
Names:
pentan-3-ylcarbamoylmethyl (2S)-2-(4-nitrophenyl)sulfonylpropanoate
ZINC07864609
Registries:
PubChem CID 8984472
PubChem ID 14219626