3-[(3S)-3-(4-dimethylaminophenyl)-3-[(4-methylphenyl)amino]propanoyl]-1-methyl-2-oxidanyl-quinolin-4-one

Systemtic Name: 3-[(3S)-3-(4-dimethylaminophenyl)-3-[(4-methylphenyl)amino]propanoyl]-1-methyl-2-oxidanyl-quinolin-4-one Openeye Name: 3-[(3S)-3-(4-dimethylaminophenyl)-3-(4-methylanilino)propanoyl]-2-hydroxy-1-methyl-quinolin-4-one CAS Name: 3-[(3S)-3-(4-dimethylaminophenyl)-3-(4-methylanilino)-1-oxopropyl]-2-hydroxy-1-methyl-4-quinolinone IUPAC Name: 3-[(3S)-3-(4-dimethylaminophenyl)-3-(4-methylanilino)propanoyl]-2-hydroxy-1-methylquinolin-4-one Traditional Name: 3-[(3S)-3-(4-dimethylaminophenyl)-3-(p-toluidino)propanoyl]-2-hydroxy-1-methyl-4-quinolone Formula: C28H29N3O3 MolecularWeight: 455.54816

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(CC(=O)C2=C(N(C3=CC=CC=C3C2=O)C)O)C4=CC=C(C=C4)N(C)C

Isomeric SMILES

CC1=CC=C(C=C1)N[C@@H](CC(=O)C2=C(N(C3=CC=CC=C3C2=O)C)O)C4=CC=C(C=C4)N(C)C

InChI

InChI=1S/C28H29N3O3/c1-18-9-13-20(14-10-18)29-23(19-11-15-21(16-12-19)30(2)3)17-25(32)26-27(33)22-7-5-6-8-24(22)31(4)28(26)34/h5-16,23,29,34H,17H2,1-4H3/t23-/m0/s1