4-(4-chlorophenyl)-1-(2-ethyl-3,4-dihydro-1H-isoquinolin-7-yl)-2-piperidin-1-yl-butane-1,4-dione

Systemtic Name: 4-(4-chlorophenyl)-1-(2-ethyl-3,4-dihydro-1H-isoquinolin-7-yl)-2-piperidin-1-yl-butane-1,4-dione Openeye Name: 4-(4-chlorophenyl)-1-(2-ethyl-3,4-dihydro-1H-isoquinolin-7-yl)-2-(1-piperidyl)butane-1,4-dione CAS Name: 4-(4-chlorophenyl)-1-(2-ethyl-3,4-dihydro-1H-isoquinolin-7-yl)-2-(1-piperidinyl)butane-1,4-dione IUPAC Name: 4-(4-chlorophenyl)-1-(2-ethyl-3,4-dihydro-1H-isoquinolin-7-yl)-2-piperidin-1-ylbutane-1,4-dione Traditional Name: 4-(4-chlorophenyl)-1-(2-ethyl-3,4-dihydro-1H-isoquinolin-7-yl)-2-piperidino-butane-1,4-dione Formula: C26H31ClN2O2 MolecularWeight: 438.98954

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCC2=C(C1)C=C(C=C2)C(=O)C(CC(=O)C3=CC=C(C=C3)Cl)N4CCCCC4

Isomeric SMILES

CCN1CCC2=C(C1)C=C(C=C2)C(=O)C(CC(=O)C3=CC=C(C=C3)Cl)N4CCCCC4

InChI

InChI=1S/C26H31ClN2O2/c1-2-28-15-12-19-6-7-21(16-22(19)18-28)26(31)24(29-13-4-3-5-14-29)17-25(30)20-8-10-23(27)11-9-20/h6-11,16,24H,2-5,12-15,17-18H2,1H3