(2S)-2-azanyl-3-[3-(4-methylphenyl)-2-oxidanylidene-1H-quinolin-6-yl]propanoic acid

Systemtic Name: (2S)-2-azanyl-3-[3-(4-methylphenyl)-2-oxidanylidene-1H-quinolin-6-yl]propanoic acid Openeye Name: (2S)-2-amino-3-[2-oxo-3-(p-tolyl)-1H-quinolin-6-yl]propanoic acid CAS Name: (2S)-2-amino-3-[3-(4-methylphenyl)-2-oxo-1H-quinolin-6-yl]propanoic acid IUPAC Name: (2S)-2-amino-3-[3-(4-methylphenyl)-2-oxo-1H-quinolin-6-yl]propanoic acid Traditional Name: (2S)-2-amino-3-[2-keto-3-(p-tolyl)-1H-quinolin-6-yl]propionic acid Formula: C19H18N2O3 MolecularWeight: 322.35782

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC3=C(C=CC(=C3)CC(C(=O)O)N)NC2=O

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC3=C(C=CC(=C3)C[C@@H](C(=O)O)N)NC2=O

InChI

InChI=1S/C19H18N2O3/c1-11-2-5-13(6-3-11)15-10-14-8-12(9-16(20)19(23)24)4-7-17(14)21-18(15)22/h2-8,10,16H,9,20H2,1H3,(H,21,22)(H,23,24)/t16-/m0/s1