(4-butylphenyl)-[(3S)-2-ethyl-3-methyl-4-phenylazanyl-3,4-dihydro-2H-quinolin-1-yl]methanone

Systemtic Name: (4-butylphenyl)-[(3S)-2-ethyl-3-methyl-4-phenylazanyl-3,4-dihydro-2H-quinolin-1-yl]methanone Openeye Name: [(3S)-4-anilino-2-ethyl-3-methyl-3,4-dihydro-2H-quinolin-1-yl]-(4-butylphenyl)methanone CAS Name: [(3S)-4-anilino-2-ethyl-3-methyl-3,4-dihydro-2H-quinolin-1-yl]-(4-butylphenyl)methanone IUPAC Name: [(3S)-4-anilino-2-ethyl-3-methyl-3,4-dihydro-2H-quinolin-1-yl]-(4-butylphenyl)methanone Traditional Name: [(3S)-4-anilino-2-ethyl-3-methyl-3,4-dihydro-2H-quinolin-1-yl]-(4-butylphenyl)methanone Formula: C29H34N2O MolecularWeight: 426.59306

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C(=O)N2C(C(C(C3=CC=CC=C32)NC4=CC=CC=C4)C)CC

Isomeric SMILES

CCCCC1=CC=C(C=C1)C(=O)N2C([C@H](C(C3=CC=CC=C32)NC4=CC=CC=C4)C)CC

InChI

InChI=1S/C29H34N2O/c1-4-6-12-22-17-19-23(20-18-22)29(32)31-26(5-2)21(3)28(25-15-10-11-16-27(25)31)30-24-13-8-7-9-14-24/h7-11,13-21,26,28,30H,4-6,12H2,1-3H3/t21-,26?,28?/m1/s1