2-[2,4-bis(oxidanylidene)-4-(propan-2-ylamino)butanehydrazonoyl]benzoic acid

Systemtic Name: 2-[2,4-bis(oxidanylidene)-4-(propan-2-ylamino)butanehydrazonoyl]benzoic acid Openeye Name: 2-[4-(isopropylamino)-2,4-dioxo-butanehydrazonoyl]benzoic acid CAS Name: 2-[(1E)-1-hydrazinylidene-2,4-dioxo-4-(propan-2-ylamino)butyl]benzoic acid IUPAC Name: 2-[2,4-dioxo-4-(propan-2-ylamino)butanehydrazonoyl]benzoic acid Traditional Name: 2-[4-(isopropylamino)-2,4-diketo-butanehydrazonoyl]benzoic acid Formula: C14H17N3O4 MolecularWeight: 291.30248

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)CC(=O)C(=NN)C1=CC=CC=C1C(=O)O

Isomeric SMILES

CC(C)NC(=O)CC(=O)/C(=N/N)/C1=CC=CC=C1C(=O)O

InChI

InChI=1S/C14H17N3O4/c1-8(2)16-12(19)7-11(18)13(17-15)9-5-3-4-6-10(9)14(20)21/h3-6,8H,7,15H2,1-2H3,(H,16,19)(H,20,21)/b17-13+