N-[2-(azepan-1-yl)-2-(1-methylpyrrol-2-yl)ethyl]-2-(3-methoxyphenyl)ethanamide

Systemtic Name: N-[2-(azepan-1-yl)-2-(1-methylpyrrol-2-yl)ethyl]-2-(3-methoxyphenyl)ethanamide Openeye Name: N-[2-(azepan-1-yl)-2-(1-methylpyrrol-2-yl)ethyl]-2-(3-methoxyphenyl)acetamide CAS Name: N-[2-(1-azepanyl)-2-(1-methyl-2-pyrrolyl)ethyl]-2-(3-methoxyphenyl)acetamide IUPAC Name: N-[2-(azepan-1-yl)-2-(1-methylpyrrol-2-yl)ethyl]-2-(3-methoxyphenyl)acetamide Traditional Name: N-[2-(azepan-1-yl)-2-(1-methylpyrrol-2-yl)ethyl]-2-(3-methoxyphenyl)acetamide Formula: C22H31N3O2 MolecularWeight: 369.50044

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1C(CNC(=O)CC2=CC(=CC=C2)OC)N3CCCCCC3

Isomeric SMILES

CN1C=CC=C1C(CNC(=O)CC2=CC(=CC=C2)OC)N3CCCCCC3

InChI

InChI=1S/C22H31N3O2/c1-24-12-8-11-20(24)21(25-13-5-3-4-6-14-25)17-23-22(26)16-18-9-7-10-19(15-18)27-2/h7-12,15,21H,3-6,13-14,16-17H2,1-2H3,(H,23,26)