4-[(4-oxidanylidene-4-pyridin-3-yl-but-2-en-2-yl)amino]benzoate

Systemtic Name: 4-[(4-oxidanylidene-4-pyridin-3-yl-but-2-en-2-yl)amino]benzoate Openeye Name: 4-[[1-methyl-3-oxo-3-(3-pyridyl)prop-1-enyl]amino]benzoate CAS Name: 4-[[4-oxo-4-(3-pyridinyl)but-2-en-2-yl]amino]benzoate IUPAC Name: 4-[(4-oxo-4-pyridin-3-ylbut-2-en-2-yl)amino]benzoate Traditional Name: 4-[[3-keto-1-methyl-3-(3-pyridyl)prop-1-enyl]amino]benzoate Formula: C16H13N2O3- MolecularWeight: 281.28602

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)C1=CN=CC=C1)NC2=CC=C(C=C2)C(=O)[O-]

Isomeric SMILES

CC(=CC(=O)C1=CN=CC=C1)NC2=CC=C(C=C2)C(=O)[O-]

InChI

InChI=1S/C16H14N2O3/c1-11(9-15(19)13-3-2-8-17-10-13)18-14-6-4-12(5-7-14)16(20)21/h2-10,18H,1H3,(H,20,21)/p-1