5,6-dimethoxy-2-[4-(2-piperidin-1-ylethyl)phenyl]-2,3-dihydroinden-1-one hydrochloride

Systemtic Name: 5,6-dimethoxy-2-[4-(2-piperidin-1-ylethyl)phenyl]-2,3-dihydroinden-1-one hydrochloride Openeye Name: 5,6-dimethoxy-2-[4-[2-(1-piperidyl)ethyl]phenyl]indan-1-one hydrochloride CAS Name: 5,6-dimethoxy-2-[4-[2-(1-piperidinyl)ethyl]phenyl]-2,3-dihydroinden-1-one hydrochloride IUPAC Name: 5,6-dimethoxy-2-[4-(2-piperidin-1-ylethyl)phenyl]-2,3-dihydroinden-1-one hydrochloride Traditional Name: 5,6-dimethoxy-2-[4-(2-piperidinoethyl)phenyl]indan-1-one hydrochloride Formula: C24H30ClNO3 MolecularWeight: 415.9529

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)CC(C2=O)C3=CC=C(C=C3)CCN4CCCCC4)OC.Cl

Isomeric SMILES

COC1=C(C=C2C(=C1)CC(C2=O)C3=CC=C(C=C3)CCN4CCCCC4)OC.Cl

InChI

InChI=1S/C24H29NO3.ClH/c1-27-22-15-19-14-20(24(26)21(19)16-23(22)28-2)18-8-6-17(7-9-18)10-13-25-11-4-3-5-12-25;/h6-9,15-16,20H,3-5,10-14H2,1-2H3;1H