4-[(E)-[[3-oxidanylidene-3-(propan-2-ylamino)propanoyl]hydrazinylidene]methyl]benzoic acid

Systemtic Name: 4-[(E)-[[3-oxidanylidene-3-(propan-2-ylamino)propanoyl]hydrazinylidene]methyl]benzoic acid Openeye Name: 4-[(E)-[[3-(isopropylamino)-3-oxo-propanoyl]hydrazono]methyl]benzoic acid CAS Name: 4-[(E)-[[1,3-dioxo-3-(propan-2-ylamino)propyl]hydrazinylidene]methyl]benzoic acid IUPAC Name: 4-[(E)-[[3-oxo-3-(propan-2-ylamino)propanoyl]hydrazinylidene]methyl]benzoic acid Traditional Name: 4-[(E)-[[3-(isopropylamino)-3-keto-propanoyl]hydrazono]methyl]benzoic acid Formula: C14H17N3O4 MolecularWeight: 291.30248

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)CC(=O)NN=CC1=CC=C(C=C1)C(=O)O

Isomeric SMILES

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

InChI

InChI=1S/C14H17N3O4/c1-9(2)16-12(18)7-13(19)17-15-8-10-3-5-11(6-4-10)14(20)21/h3-6,8-9H,7H2,1-2H3,(H,16,18)(H,17,19)(H,20,21)/b15-8+