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

Systemtic Name: 5,6-dimethoxy-2-[4-(4-pyrrolidin-1-ylbutyl)phenoxy]-2,3-dihydroinden-1-one Openeye Name: 5,6-dimethoxy-2-[4-(4-pyrrolidin-1-ylbutyl)phenoxy]indan-1-one CAS Name: 5,6-dimethoxy-2-[4-[4-(1-pyrrolidinyl)butyl]phenoxy]-2,3-dihydroinden-1-one IUPAC Name: 5,6-dimethoxy-2-[4-(4-pyrrolidin-1-ylbutyl)phenoxy]-2,3-dihydroinden-1-one Traditional Name: 5,6-dimethoxy-2-[4-(4-pyrrolidinobutyl)phenoxy]indan-1-one Formula: C25H31NO4 MolecularWeight: 409.51794

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)CC(C2=O)OC3=CC=C(C=C3)CCCCN4CCCC4)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)CC(C2=O)OC3=CC=C(C=C3)CCCCN4CCCC4)OC

InChI

InChI=1S/C25H31NO4/c1-28-22-15-19-16-24(25(27)21(19)17-23(22)29-2)30-20-10-8-18(9-11-20)7-3-4-12-26-13-5-6-14-26/h8-11,15,17,24H,3-7,12-14,16H2,1-2H3