methyl (2S)-2-[3-(2-oxidanylidene-3,4-dihydro-1H-quinolin-3-yl)propanoylamino]-3-phenyl-propanoate

Systemtic Name: methyl (2S)-2-[3-(2-oxidanylidene-3,4-dihydro-1H-quinolin-3-yl)propanoylamino]-3-phenyl-propanoate Openeye Name: methyl (2S)-2-[3-(2-oxo-3,4-dihydro-1H-quinolin-3-yl)propanoylamino]-3-phenyl-propanoate CAS Name: (2S)-2-[[1-oxo-3-(2-oxo-3,4-dihydro-1H-quinolin-3-yl)propyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl (2S)-2-[3-(2-oxo-3,4-dihydro-1H-quinolin-3-yl)propanoylamino]-3-phenylpropanoate Traditional Name: (2S)-2-[3-(2-keto-3,4-dihydro-1H-quinolin-3-yl)propanoylamino]-3-phenyl-propionic acid methyl ester Formula: C22H24N2O4 MolecularWeight: 380.43696

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC=CC=C1)NC(=O)CCC2CC3=CC=CC=C3NC2=O

Isomeric SMILES

COC(=O)[C@H](CC1=CC=CC=C1)NC(=O)CCC2CC3=CC=CC=C3NC2=O

InChI

InChI=1S/C22H24N2O4/c1-28-22(27)19(13-15-7-3-2-4-8-15)23-20(25)12-11-17-14-16-9-5-6-10-18(16)24-21(17)26/h2-10,17,19H,11-14H2,1H3,(H,23,25)(H,24,26)/t17?,19-/m0/s1