(5S)-5-(3-chlorophenyl)-3-(2-methylpropylamino)cyclohex-2-en-1-one

Systemtic Name: (5S)-5-(3-chlorophenyl)-3-(2-methylpropylamino)cyclohex-2-en-1-one Openeye Name: (5S)-5-(3-chlorophenyl)-3-(isobutylamino)cyclohex-2-en-1-one CAS Name: (5S)-5-(3-chlorophenyl)-3-(2-methylpropylamino)-1-cyclohex-2-enone IUPAC Name: (5S)-5-(3-chlorophenyl)-3-(2-methylpropylamino)cyclohex-2-en-1-one Traditional Name: (5S)-5-(3-chlorophenyl)-3-(isobutylamino)cyclohex-2-en-1-one Formula: C16H20ClNO MolecularWeight: 277.7891

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC1=CC(=O)CC(C1)C2=CC(=CC=C2)Cl

Isomeric SMILES

CC(C)CNC1=CC(=O)C[C@H](C1)C2=CC(=CC=C2)Cl

InChI

InChI=1S/C16H20ClNO/c1-11(2)10-18-15-7-13(8-16(19)9-15)12-4-3-5-14(17)6-12/h3-6,9,11,13,18H,7-8,10H2,1-2H3/t13-/m0/s1