4-[[6-[(4-methylphenyl)methylamino]pyridin-3-yl]amino]-4-oxidanylidene-butanoate

Systemtic Name: 4-[[6-[(4-methylphenyl)methylamino]pyridin-3-yl]amino]-4-oxidanylidene-butanoate Openeye Name: 4-oxo-4-[[6-(p-tolylmethylamino)-3-pyridyl]amino]butanoate CAS Name: 4-[[6-[(4-methylphenyl)methylamino]-3-pyridinyl]amino]-4-oxobutanoate IUPAC Name: 4-[[6-[(4-methylphenyl)methylamino]pyridin-3-yl]amino]-4-oxobutanoate Traditional Name: 4-keto-4-[[6-[(4-methylbenzyl)amino]-3-pyridyl]amino]butyrate Formula: C17H18N3O3- MolecularWeight: 312.34312

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC2=NC=C(C=C2)NC(=O)CCC(=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)CNC2=NC=C(C=C2)NC(=O)CCC(=O)[O-]

InChI

InChI=1S/C17H19N3O3/c1-12-2-4-13(5-3-12)10-18-15-7-6-14(11-19-15)20-16(21)8-9-17(22)23/h2-7,11H,8-10H2,1H3,(H,18,19)(H,20,21)(H,22,23)/p-1