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

Systemtic Name: (2S)-2-methyl-1-[(2S,4S)-2-methyl-4-phenylazanyl-3,4-dihydro-2H-quinolin-1-yl]butan-1-one Openeye Name: (2S)-1-[(2S,4S)-4-anilino-2-methyl-3,4-dihydro-2H-quinolin-1-yl]-2-methyl-butan-1-one CAS Name: (2S)-1-[(2S,4S)-4-anilino-2-methyl-3,4-dihydro-2H-quinolin-1-yl]-2-methyl-1-butanone IUPAC Name: (2S)-1-[(2S,4S)-4-anilino-2-methyl-3,4-dihydro-2H-quinolin-1-yl]-2-methylbutan-1-one Traditional Name: (2S)-1-[(2S,4S)-4-anilino-2-methyl-3,4-dihydro-2H-quinolin-1-yl]-2-methyl-butan-1-one Formula: C21H26N2O MolecularWeight: 322.44394

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(=O)N1C(CC(C2=CC=CC=C21)NC3=CC=CC=C3)C

Isomeric SMILES

CC[C@H](C)C(=O)N1[C@H](C[C@@H](C2=CC=CC=C21)NC3=CC=CC=C3)C

InChI

InChI=1S/C21H26N2O/c1-4-15(2)21(24)23-16(3)14-19(18-12-8-9-13-20(18)23)22-17-10-6-5-7-11-17/h5-13,15-16,19,22H,4,14H2,1-3H3/t15-,16-,19-/m0/s1