N-[3-[6,8-bis(chloranyl)-2-methyl-3,4-dihydro-1H-isoquinolin-4-yl]phenyl]-1-ethanoyl-piperidine-4-carboxamide

Systemtic Name: N-[3-[6,8-bis(chloranyl)-2-methyl-3,4-dihydro-1H-isoquinolin-4-yl]phenyl]-1-ethanoyl-piperidine-4-carboxamide Openeye Name: 1-acetyl-N-[3-(6,8-dichloro-2-methyl-3,4-dihydro-1H-isoquinolin-4-yl)phenyl]piperidine-4-carboxamide CAS Name: 1-acetyl-N-[3-(6,8-dichloro-2-methyl-3,4-dihydro-1H-isoquinolin-4-yl)phenyl]-4-piperidinecarboxamide IUPAC Name: 1-acetyl-N-[3-(6,8-dichloro-2-methyl-3,4-dihydro-1H-isoquinolin-4-yl)phenyl]piperidine-4-carboxamide Traditional Name: 1-acetyl-N-[3-(6,8-dichloro-2-methyl-3,4-dihydro-1H-isoquinolin-4-yl)phenyl]isonipecotamide Formula: C24H27Cl2N3O2 MolecularWeight: 460.39608

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCC(CC1)C(=O)NC2=CC=CC(=C2)C3CN(CC4=C(C=C(C=C34)Cl)Cl)C

Isomeric SMILES

CC(=O)N1CCC(CC1)C(=O)NC2=CC=CC(=C2)C3CN(CC4=C(C=C(C=C34)Cl)Cl)C

InChI

InChI=1S/C24H27Cl2N3O2/c1-15(30)29-8-6-16(7-9-29)24(31)27-19-5-3-4-17(10-19)21-13-28(2)14-22-20(21)11-18(25)12-23(22)26/h3-5,10-12,16,21H,6-9,13-14H2,1-2H3,(H,27,31)