1-(1,3-benzodioxol-5-yl)-4-[2-(4-methoxyphenyl)azepan-1-yl]carbonyl-pyrrolidin-2-one

Systemtic Name: 1-(1,3-benzodioxol-5-yl)-4-[2-(4-methoxyphenyl)azepan-1-yl]carbonyl-pyrrolidin-2-one Openeye Name: 1-(1,3-benzodioxol-5-yl)-4-[2-(4-methoxyphenyl)azepane-1-carbonyl]pyrrolidin-2-one CAS Name: 1-(1,3-benzodioxol-5-yl)-4-[[2-(4-methoxyphenyl)-1-azepanyl]-oxomethyl]-2-pyrrolidinone IUPAC Name: 1-(1,3-benzodioxol-5-yl)-4-[2-(4-methoxyphenyl)azepane-1-carbonyl]pyrrolidin-2-one Traditional Name: 1-(1,3-benzodioxol-5-yl)-4-[2-(4-methoxyphenyl)azepane-1-carbonyl]-2-pyrrolidone Formula: C25H28N2O5 MolecularWeight: 436.50022

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2CCCCCN2C(=O)C3CC(=O)N(C3)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

COC1=CC=C(C=C1)C2CCCCCN2C(=O)C3CC(=O)N(C3)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C25H28N2O5/c1-30-20-9-6-17(7-10-20)21-5-3-2-4-12-26(21)25(29)18-13-24(28)27(15-18)19-8-11-22-23(14-19)32-16-31-22/h6-11,14,18,21H,2-5,12-13,15-16H2,1H3