4-oxidanylidene-2-(phenylmethyl)-4-(3-pyridin-4-ylpropylamino)butanoate

Systemtic Name: 4-oxidanylidene-2-(phenylmethyl)-4-(3-pyridin-4-ylpropylamino)butanoate Openeye Name: 2-benzyl-4-oxo-4-[3-(4-pyridyl)propylamino]butanoate CAS Name: 4-oxo-2-(phenylmethyl)-4-(3-pyridin-4-ylpropylamino)butanoate IUPAC Name: 2-benzyl-4-oxo-4-(3-pyridin-4-ylpropylamino)butanoate Traditional Name: 2-benzyl-4-keto-4-[3-(4-pyridyl)propylamino]butyrate Formula: C19H21N2O3- MolecularWeight: 325.38164

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(CC(=O)NCCCC2=CC=NC=C2)C(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CC(CC(=O)NCCCC2=CC=NC=C2)C(=O)[O-]

InChI

InChI=1S/C19H22N2O3/c22-18(21-10-4-7-15-8-11-20-12-9-15)14-17(19(23)24)13-16-5-2-1-3-6-16/h1-3,5-6,8-9,11-12,17H,4,7,10,13-14H2,(H,21,22)(H,23,24)/p-1