2-[2,4-bis(oxidanylidene)-4-[(phenylmethyl)amino]butanehydrazonoyl]benzoic acid

Systemtic Name: 2-[2,4-bis(oxidanylidene)-4-[(phenylmethyl)amino]butanehydrazonoyl]benzoic acid Openeye Name: 2-[4-(benzylamino)-2,4-dioxo-butanehydrazonoyl]benzoic acid CAS Name: 2-[(1E)-1-hydrazinylidene-2,4-dioxo-4-[(phenylmethyl)amino]butyl]benzoic acid IUPAC Name: 2-[4-(benzylamino)-2,4-dioxobutanehydrazonoyl]benzoic acid Traditional Name: 2-[4-(benzylamino)-2,4-diketo-butanehydrazonoyl]benzoic acid Formula: C18H17N3O4 MolecularWeight: 339.34528

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=O)CC(=O)C(=NN)C2=CC=CC=C2C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CNC(=O)CC(=O)/C(=N/N)/C2=CC=CC=C2C(=O)O

InChI

InChI=1S/C18H17N3O4/c19-21-17(13-8-4-5-9-14(13)18(24)25)15(22)10-16(23)20-11-12-6-2-1-3-7-12/h1-9H,10-11,19H2,(H,20,23)(H,24,25)/b21-17+