2-[2-(4-methoxyphenyl)azepan-1-yl]-1-(5-pyrrolidin-1-ylcarbonyl-1H-pyrrol-3-yl)ethanone

Systemtic Name: 2-[2-(4-methoxyphenyl)azepan-1-yl]-1-(5-pyrrolidin-1-ylcarbonyl-1H-pyrrol-3-yl)ethanone Openeye Name: 2-[2-(4-methoxyphenyl)azepan-1-yl]-1-[5-(pyrrolidine-1-carbonyl)-1H-pyrrol-3-yl]ethanone CAS Name: 2-[2-(4-methoxyphenyl)-1-azepanyl]-1-[5-[oxo(1-pyrrolidinyl)methyl]-1H-pyrrol-3-yl]ethanone IUPAC Name: 2-[2-(4-methoxyphenyl)azepan-1-yl]-1-[5-(pyrrolidine-1-carbonyl)-1H-pyrrol-3-yl]ethanone Traditional Name: 2-[2-(4-methoxyphenyl)azepan-1-yl]-1-[5-(pyrrolidine-1-carbonyl)-1H-pyrrol-3-yl]ethanone Formula: C24H31N3O3 MolecularWeight: 409.52124

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2CCCCCN2CC(=O)C3=CNC(=C3)C(=O)N4CCCC4

Isomeric SMILES

COC1=CC=C(C=C1)C2CCCCCN2CC(=O)C3=CNC(=C3)C(=O)N4CCCC4

InChI

InChI=1S/C24H31N3O3/c1-30-20-10-8-18(9-11-20)22-7-3-2-4-14-27(22)17-23(28)19-15-21(25-16-19)24(29)26-12-5-6-13-26/h8-11,15-16,22,25H,2-7,12-14,17H2,1H3