1-[2-oxidanylidene-2-[2-(2-pyrrol-1-ylphenyl)carbonylhydrazinyl]ethyl]cycloheptane-1-carboxylic acid

Systemtic Name: 1-[2-oxidanylidene-2-[2-(2-pyrrol-1-ylphenyl)carbonylhydrazinyl]ethyl]cycloheptane-1-carboxylic acid Openeye Name: 1-[2-oxo-2-[2-(2-pyrrol-1-ylbenzoyl)hydrazino]ethyl]cycloheptanecarboxylic acid CAS Name: 1-[2-oxo-2-[[oxo-[2-(1-pyrrolyl)phenyl]methyl]hydrazo]ethyl]-1-cycloheptanecarboxylic acid IUPAC Name: 1-[2-oxo-2-[2-(2-pyrrol-1-ylbenzoyl)hydrazinyl]ethyl]cycloheptane-1-carboxylic acid Traditional Name: 1-[2-keto-2-[N'-(2-pyrrol-1-ylbenzoyl)hydrazino]ethyl]cycloheptanecarboxylic acid Formula: C21H25N3O4 MolecularWeight: 383.4409

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)(CC(=O)NNC(=O)C2=CC=CC=C2N3C=CC=C3)C(=O)O

Isomeric SMILES

C1CCCC(CC1)(CC(=O)NNC(=O)C2=CC=CC=C2N3C=CC=C3)C(=O)O

InChI

InChI=1S/C21H25N3O4/c25-18(15-21(20(27)28)11-5-1-2-6-12-21)22-23-19(26)16-9-3-4-10-17(16)24-13-7-8-14-24/h3-4,7-10,13-14H,1-2,5-6,11-12,15H2,(H,22,25)(H,23,26)(H,27,28)