[6-butyl-2-oxidanylidene-3-(3-phenylpropanoylamino)pyridin-1-yl] propanoate

Systemtic Name: [6-butyl-2-oxidanylidene-3-(3-phenylpropanoylamino)pyridin-1-yl] propanoate Openeye Name: [6-butyl-2-oxo-3-(3-phenylpropanoylamino)-1-pyridyl] propanoate CAS Name: propanoic acid [6-butyl-2-oxo-3-[(1-oxo-3-phenylpropyl)amino]-1-pyridinyl] ester IUPAC Name: [6-butyl-2-oxo-3-(3-phenylpropanoylamino)pyridin-1-yl] propanoate Traditional Name: propionic acid [6-butyl-3-(hydrocinnamoylamino)-2-keto-1-pyridyl] ester Formula: C21H26N2O4 MolecularWeight: 370.44214

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C(=O)N1OC(=O)CC)NC(=O)CCC2=CC=CC=C2

Isomeric SMILES

CCCCC1=CC=C(C(=O)N1OC(=O)CC)NC(=O)CCC2=CC=CC=C2

InChI

InChI=1S/C21H26N2O4/c1-3-5-11-17-13-14-18(21(26)23(17)27-20(25)4-2)22-19(24)15-12-16-9-7-6-8-10-16/h6-10,13-14H,3-5,11-12,15H2,1-2H3,(H,22,24)