[4-[4-[(3,4-dichlorophenyl)methyl]piperidin-1-yl]piperidin-1-yl]-isoquinolin-1-yl-methanone

Systemtic Name: [4-[4-[(3,4-dichlorophenyl)methyl]piperidin-1-yl]piperidin-1-yl]-isoquinolin-1-yl-methanone Openeye Name: [4-[4-[(3,4-dichlorophenyl)methyl]-1-piperidyl]-1-piperidyl]-(1-isoquinolyl)methanone CAS Name: [4-[4-[(3,4-dichlorophenyl)methyl]-1-piperidinyl]-1-piperidinyl]-(1-isoquinolinyl)methanone IUPAC Name: [4-[4-[(3,4-dichlorophenyl)methyl]piperidin-1-yl]piperidin-1-yl]-isoquinolin-1-ylmethanone Traditional Name: [4-[4-(3,4-dichlorobenzyl)piperidino]piperidino]-(1-isoquinolyl)methanone Formula: C27H29Cl2N3O MolecularWeight: 482.44466

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC2=CC(=C(C=C2)Cl)Cl)C3CCN(CC3)C(=O)C4=NC=CC5=CC=CC=C54

Isomeric SMILES

C1CN(CCC1CC2=CC(=C(C=C2)Cl)Cl)C3CCN(CC3)C(=O)C4=NC=CC5=CC=CC=C54

InChI

InChI=1S/C27H29Cl2N3O/c28-24-6-5-20(18-25(24)29)17-19-8-13-31(14-9-19)22-10-15-32(16-11-22)27(33)26-23-4-2-1-3-21(23)7-12-30-26/h1-7,12,18-19,22H,8-11,13-17H2