4-oxidanylidene-4-[[5-[(phenylmethyl)-propan-2-yl-amino]pyridin-2-yl]amino]butanoate

Systemtic Name: 4-oxidanylidene-4-[[5-[(phenylmethyl)-propan-2-yl-amino]pyridin-2-yl]amino]butanoate Openeye Name: 4-[[5-[benzyl(isopropyl)amino]-2-pyridyl]amino]-4-oxo-butanoate CAS Name: 4-oxo-4-[[5-[(phenylmethyl)-propan-2-ylamino]-2-pyridinyl]amino]butanoate IUPAC Name: 4-[[5-[benzyl(propan-2-yl)amino]pyridin-2-yl]amino]-4-oxobutanoate Traditional Name: 4-[[5-[benzyl(isopropyl)amino]-2-pyridyl]amino]-4-keto-butyrate Formula: C19H22N3O3- MolecularWeight: 340.39628

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H23N3O3/c1-14(2)22(13-15-6-4-3-5-7-15)16-8-9-17(20-12-16)21-18(23)10-11-19(24)25/h3-9,12,14H,10-11,13H2,1-2H3,(H,24,25)(H,20,21,23)/p-1