benzyl 4-(2-methoxycarbonylethyl)-3,5-dimethyl-1H-pyrrole-2-carboxylate hydrate
Molecular Formula:
C
18
H
23
NO
5
InChI:
InChI=1/C18H21NO4.H2O/c1-12-15(9-10-16(20)22-3)13(2)19-17(12)18(21)23-11-14-7-5-4-6-8-14;/h4-8,19H,9-11H2,1-3H3;1H2
InChIKey:
InChIKey=FXTHKTIQGOTTPS-UHFFFAOYAZ
SMILES:
CC1=C(NC(=C1CCC(=O)OC)C)C(=O)OCC2=CC=CC=C2.O
Names:
benzyl 4-(2-methoxycarbonylethyl)-3,5-dimethyl-1H-pyrrole-2-carboxylate hydrate
Registries:
PubChem CID 2825282
PubChem ID 3286122