[2-(cycloheptylamino)-2-oxidanylidene-ethyl] 2-[2-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)hydrazinyl]benzoate

Systemtic Name: [2-(cycloheptylamino)-2-oxidanylidene-ethyl] 2-[2-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)hydrazinyl]benzoate Openeye Name: [2-(cycloheptylamino)-2-oxo-ethyl] 2-[2-(4-oxocyclohexa-2,5-dien-1-ylidene)hydrazino]benzoate CAS Name: 2-[2-(4-oxo-1-cyclohexa-2,5-dienylidene)hydrazinyl]benzoic acid [2-(cycloheptylamino)-2-oxoethyl] ester IUPAC Name: [2-(cycloheptylamino)-2-oxoethyl] 2-[2-(4-oxocyclohexa-2,5-dien-1-ylidene)hydrazinyl]benzoate Traditional Name: 2-[N'-(4-ketocyclohexa-2,5-dien-1-ylidene)hydrazino]benzoic acid [2-(cycloheptylamino)-2-keto-ethyl] ester Formula: C22H25N3O4 MolecularWeight: 395.4516

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)NC(=O)COC(=O)C2=CC=CC=C2NN=C3C=CC(=O)C=C3

Isomeric SMILES

C1CCCC(CC1)NC(=O)COC(=O)C2=CC=CC=C2NN=C3C=CC(=O)C=C3

InChI

InChI=1S/C22H25N3O4/c26-18-13-11-17(12-14-18)24-25-20-10-6-5-9-19(20)22(28)29-15-21(27)23-16-7-3-1-2-4-8-16/h5-6,9-14,16,25H,1-4,7-8,15H2,(H,23,27)