2-[4-(5-chloranyl-3,4-dihydro-1H-isoquinolin-2-yl)butyl]-5,6-dimethoxy-2,3-dihydroinden-1-one

Systemtic Name: 2-[4-(5-chloranyl-3,4-dihydro-1H-isoquinolin-2-yl)butyl]-5,6-dimethoxy-2,3-dihydroinden-1-one Openeye Name: 2-[4-(5-chloro-3,4-dihydro-1H-isoquinolin-2-yl)butyl]-5,6-dimethoxy-indan-1-one CAS Name: 2-[4-(5-chloro-3,4-dihydro-1H-isoquinolin-2-yl)butyl]-5,6-dimethoxy-2,3-dihydroinden-1-one IUPAC Name: 2-[4-(5-chloro-3,4-dihydro-1H-isoquinolin-2-yl)butyl]-5,6-dimethoxy-2,3-dihydroinden-1-one Traditional Name: 2-[4-(5-chloro-3,4-dihydro-1H-isoquinolin-2-yl)butyl]-5,6-dimethoxy-indan-1-one Formula: C24H28ClNO3 MolecularWeight: 413.93702

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)CC(C2=O)CCCCN3CCC4=C(C3)C=CC=C4Cl)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)CC(C2=O)CCCCN3CCC4=C(C3)C=CC=C4Cl)OC

InChI

InChI=1S/C24H28ClNO3/c1-28-22-13-18-12-16(24(27)20(18)14-23(22)29-2)6-3-4-10-26-11-9-19-17(15-26)7-5-8-21(19)25/h5,7-8,13-14,16H,3-4,6,9-12,15H2,1-2H3