(2S)-1-[(2S,4S)-2-methyl-4-phenylazanyl-3,4-dihydro-2H-quinolin-1-yl]-2-phenyl-butan-1-one

Systemtic Name: (2S)-1-[(2S,4S)-2-methyl-4-phenylazanyl-3,4-dihydro-2H-quinolin-1-yl]-2-phenyl-butan-1-one Openeye Name: (2S)-1-[(2S,4S)-4-anilino-2-methyl-3,4-dihydro-2H-quinolin-1-yl]-2-phenyl-butan-1-one CAS Name: (2S)-1-[(2S,4S)-4-anilino-2-methyl-3,4-dihydro-2H-quinolin-1-yl]-2-phenyl-1-butanone IUPAC Name: (2S)-1-[(2S,4S)-4-anilino-2-methyl-3,4-dihydro-2H-quinolin-1-yl]-2-phenylbutan-1-one Traditional Name: (2S)-1-[(2S,4S)-4-anilino-2-methyl-3,4-dihydro-2H-quinolin-1-yl]-2-phenyl-butan-1-one Formula: C26H28N2O MolecularWeight: 384.51332

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)C(=O)N2C(CC(C3=CC=CC=C32)NC4=CC=CC=C4)C

Isomeric SMILES

CC[C@@H](C1=CC=CC=C1)C(=O)N2[C@H](C[C@@H](C3=CC=CC=C32)NC4=CC=CC=C4)C

InChI

InChI=1S/C26H28N2O/c1-3-22(20-12-6-4-7-13-20)26(29)28-19(2)18-24(23-16-10-11-17-25(23)28)27-21-14-8-5-9-15-21/h4-17,19,22,24,27H,3,18H2,1-2H3/t19-,22-,24-/m0/s1