1-[[3-[(2R)-2-(4-methoxyphenyl)azepan-1-yl]carbonylphenyl]methyl]pyrrolidin-2-one

Systemtic Name: 1-[[3-[(2R)-2-(4-methoxyphenyl)azepan-1-yl]carbonylphenyl]methyl]pyrrolidin-2-one Openeye Name: 1-[[3-[(2R)-2-(4-methoxyphenyl)azepane-1-carbonyl]phenyl]methyl]pyrrolidin-2-one CAS Name: 1-[[3-[[(2R)-2-(4-methoxyphenyl)-1-azepanyl]-oxomethyl]phenyl]methyl]-2-pyrrolidinone IUPAC Name: 1-[[3-[(2R)-2-(4-methoxyphenyl)azepane-1-carbonyl]phenyl]methyl]pyrrolidin-2-one Traditional Name: 1-[3-[(2R)-2-(4-methoxyphenyl)azepane-1-carbonyl]benzyl]-2-pyrrolidone Formula: C25H30N2O3 MolecularWeight: 406.5173

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2CCCCCN2C(=O)C3=CC(=CC=C3)CN4CCCC4=O

Isomeric SMILES

COC1=CC=C(C=C1)[C@H]2CCCCCN2C(=O)C3=CC(=CC=C3)CN4CCCC4=O

InChI

InChI=1S/C25H30N2O3/c1-30-22-13-11-20(12-14-22)23-9-3-2-4-16-27(23)25(29)21-8-5-7-19(17-21)18-26-15-6-10-24(26)28/h5,7-8,11-14,17,23H,2-4,6,9-10,15-16,18H2,1H3/t23-/m1/s1