5,6-dimethoxy-2-[8-(4-phenylpiperidin-1-yl)octyl]-2,3-dihydro-1H-indene-4,7-dione hydrochloride

Systemtic Name: 5,6-dimethoxy-2-[8-(4-phenylpiperidin-1-yl)octyl]-2,3-dihydro-1H-indene-4,7-dione hydrochloride Openeye Name: 5,6-dimethoxy-2-[8-(4-phenyl-1-piperidyl)octyl]-2,3-dihydro-1H-indene-4,7-dione hydrochloride CAS Name: 5,6-dimethoxy-2-[8-(4-phenyl-1-piperidinyl)octyl]-2,3-dihydro-1H-indene-4,7-dione hydrochloride IUPAC Name: 5,6-dimethoxy-2-[8-(4-phenylpiperidin-1-yl)octyl]-2,3-dihydro-1H-indene-4,7-dione hydrochloride Traditional Name: 5,6-dimethoxy-2-[8-(4-phenylpiperidino)octyl]-2,3-dihydro-1H-indene-4,7-quinone hydrochloride Formula: C30H42ClNO4 MolecularWeight: 516.11178

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=O)C2=C(C1=O)CC(C2)CCCCCCCCN3CCC(CC3)C4=CC=CC=C4)OC.Cl

Isomeric SMILES

COC1=C(C(=O)C2=C(C1=O)CC(C2)CCCCCCCCN3CCC(CC3)C4=CC=CC=C4)OC.Cl

InChI

InChI=1S/C30H41NO4.ClH/c1-34-29-27(32)25-20-22(21-26(25)28(33)30(29)35-2)12-8-5-3-4-6-11-17-31-18-15-24(16-19-31)23-13-9-7-10-14-23;/h7,9-10,13-14,22,24H,3-6,8,11-12,15-21H2,1-2H3;1H