1-(azepan-1-yl)-3-(3-methoxyphenyl)-3-pyrrol-1-yl-propan-1-one

Systemtic Name: 1-(azepan-1-yl)-3-(3-methoxyphenyl)-3-pyrrol-1-yl-propan-1-one Openeye Name: 1-(azepan-1-yl)-3-(3-methoxyphenyl)-3-pyrrol-1-yl-propan-1-one CAS Name: 1-(1-azepanyl)-3-(3-methoxyphenyl)-3-(1-pyrrolyl)-1-propanone IUPAC Name: 1-(azepan-1-yl)-3-(3-methoxyphenyl)-3-pyrrol-1-ylpropan-1-one Traditional Name: 1-(azepan-1-yl)-3-(3-methoxyphenyl)-3-pyrrol-1-yl-propan-1-one Formula: C20H26N2O2 MolecularWeight: 326.43264

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(CC(=O)N2CCCCCC2)N3C=CC=C3

Isomeric SMILES

COC1=CC=CC(=C1)C(CC(=O)N2CCCCCC2)N3C=CC=C3

InChI

InChI=1S/C20H26N2O2/c1-24-18-10-8-9-17(15-18)19(21-11-6-7-12-21)16-20(23)22-13-4-2-3-5-14-22/h6-12,15,19H,2-5,13-14,16H2,1H3