5,6-dimethoxy-2-[4-(4-piperidin-1-ylbutyl)phenoxy]-2,3-dihydroinden-1-one

Systemtic Name: 5,6-dimethoxy-2-[4-(4-piperidin-1-ylbutyl)phenoxy]-2,3-dihydroinden-1-one Openeye Name: 5,6-dimethoxy-2-[4-[4-(1-piperidyl)butyl]phenoxy]indan-1-one CAS Name: 5,6-dimethoxy-2-[4-[4-(1-piperidinyl)butyl]phenoxy]-2,3-dihydroinden-1-one IUPAC Name: 5,6-dimethoxy-2-[4-(4-piperidin-1-ylbutyl)phenoxy]-2,3-dihydroinden-1-one Traditional Name: 5,6-dimethoxy-2-[4-(4-piperidinobutyl)phenoxy]indan-1-one Formula: C26H33NO4 MolecularWeight: 423.54452

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)CC(C2=O)OC3=CC=C(C=C3)CCCCN4CCCCC4)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)CC(C2=O)OC3=CC=C(C=C3)CCCCN4CCCCC4)OC

InChI

InChI=1S/C26H33NO4/c1-29-23-16-20-17-25(26(28)22(20)18-24(23)30-2)31-21-11-9-19(10-12-21)8-4-7-15-27-13-5-3-6-14-27/h9-12,16,18,25H,3-8,13-15,17H2,1-2H3