1-[1-(azocan-1-ylmethyl)-3,4-dihydro-1H-isoquinolin-2-yl]-2-(3,4-dichlorophenyl)ethanone

Systemtic Name: 1-[1-(azocan-1-ylmethyl)-3,4-dihydro-1H-isoquinolin-2-yl]-2-(3,4-dichlorophenyl)ethanone Openeye Name: 1-[1-(azocan-1-ylmethyl)-3,4-dihydro-1H-isoquinolin-2-yl]-2-(3,4-dichlorophenyl)ethanone CAS Name: 1-[1-(1-azocanylmethyl)-3,4-dihydro-1H-isoquinolin-2-yl]-2-(3,4-dichlorophenyl)ethanone IUPAC Name: 1-[1-(azocan-1-ylmethyl)-3,4-dihydro-1H-isoquinolin-2-yl]-2-(3,4-dichlorophenyl)ethanone Traditional Name: 1-[1-(azocan-1-ylmethyl)-3,4-dihydro-1H-isoquinolin-2-yl]-2-(3,4-dichlorophenyl)ethanone Formula: C25H30Cl2N2O MolecularWeight: 445.4245

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CCC1)CC2C3=CC=CC=C3CCN2C(=O)CC4=CC(=C(C=C4)Cl)Cl

Isomeric SMILES

C1CCCN(CCC1)CC2C3=CC=CC=C3CCN2C(=O)CC4=CC(=C(C=C4)Cl)Cl

InChI

InChI=1S/C25H30Cl2N2O/c26-22-11-10-19(16-23(22)27)17-25(30)29-15-12-20-8-4-5-9-21(20)24(29)18-28-13-6-2-1-3-7-14-28/h4-5,8-11,16,24H,1-3,6-7,12-15,17-18H2