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

Systemtic Name: 5,6-dimethoxy-2-[3-(pyrrolidin-1-ylmethyl)phenoxy]-2,3-dihydroinden-1-one Openeye Name: 5,6-dimethoxy-2-[3-(pyrrolidin-1-ylmethyl)phenoxy]indan-1-one CAS Name: 5,6-dimethoxy-2-[3-(1-pyrrolidinylmethyl)phenoxy]-2,3-dihydroinden-1-one IUPAC Name: 5,6-dimethoxy-2-[3-(pyrrolidin-1-ylmethyl)phenoxy]-2,3-dihydroinden-1-one Traditional Name: 5,6-dimethoxy-2-[3-(pyrrolidinomethyl)phenoxy]indan-1-one Formula: C22H25NO4 MolecularWeight: 367.4382

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)CC(C2=O)OC3=CC=CC(=C3)CN4CCCC4)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)CC(C2=O)OC3=CC=CC(=C3)CN4CCCC4)OC

InChI

InChI=1S/C22H25NO4/c1-25-19-11-16-12-21(22(24)18(16)13-20(19)26-2)27-17-7-5-6-15(10-17)14-23-8-3-4-9-23/h5-7,10-11,13,21H,3-4,8-9,12,14H2,1-2H3