4-[(Z)-[[2-(azepan-1-yl)-2-oxidanylidene-ethanoyl]hydrazinylidene]methyl]benzoic acid

Systemtic Name: 4-[(Z)-[[2-(azepan-1-yl)-2-oxidanylidene-ethanoyl]hydrazinylidene]methyl]benzoic acid Openeye Name: 4-[(Z)-[[2-(azepan-1-yl)-2-oxo-acetyl]hydrazono]methyl]benzoic acid CAS Name: 4-[(Z)-[[2-(1-azepanyl)-1,2-dioxoethyl]hydrazinylidene]methyl]benzoic acid IUPAC Name: 4-[(Z)-[[2-(azepan-1-yl)-2-oxoacetyl]hydrazinylidene]methyl]benzoic acid Traditional Name: 4-[(Z)-[[2-(azepan-1-yl)-2-keto-acetyl]hydrazono]methyl]benzoic acid Formula: C16H19N3O4 MolecularWeight: 317.33976

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C(=O)NN=CC2=CC=C(C=C2)C(=O)O

Isomeric SMILES

C1CCCN(CC1)C(=O)C(=O)N/N=C\C2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C16H19N3O4/c20-14(15(21)19-9-3-1-2-4-10-19)18-17-11-12-5-7-13(8-6-12)16(22)23/h5-8,11H,1-4,9-10H2,(H,18,20)(H,22,23)/b17-11-