4-(4-chlorophenyl)-1-[(3S)-3-[(4-methoxyphenyl)amino]piperidin-1-yl]butan-1-one

Systemtic Name: 4-(4-chlorophenyl)-1-[(3S)-3-[(4-methoxyphenyl)amino]piperidin-1-yl]butan-1-one Openeye Name: 4-(4-chlorophenyl)-1-[(3S)-3-(4-methoxyanilino)-1-piperidyl]butan-1-one CAS Name: 4-(4-chlorophenyl)-1-[(3S)-3-(4-methoxyanilino)-1-piperidinyl]-1-butanone IUPAC Name: 4-(4-chlorophenyl)-1-[(3S)-3-(4-methoxyanilino)piperidin-1-yl]butan-1-one Traditional Name: 4-(4-chlorophenyl)-1-[(3S)-3-(p-anisidino)piperidino]butan-1-one Formula: C22H27ClN2O2 MolecularWeight: 386.91498

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC2CCCN(C2)C(=O)CCCC3=CC=C(C=C3)Cl

Isomeric SMILES

COC1=CC=C(C=C1)N[C@H]2CCCN(C2)C(=O)CCCC3=CC=C(C=C3)Cl

InChI

InChI=1S/C22H27ClN2O2/c1-27-21-13-11-19(12-14-21)24-20-5-3-15-25(16-20)22(26)6-2-4-17-7-9-18(23)10-8-17/h7-14,20,24H,2-6,15-16H2,1H3/t20-/m0/s1