N-[2-(azepan-1-yl)phenyl]-4-ethanoyl-3,5-dimethyl-1H-pyrrole-2-carboxamide

Systemtic Name: N-[2-(azepan-1-yl)phenyl]-4-ethanoyl-3,5-dimethyl-1H-pyrrole-2-carboxamide Openeye Name: 4-acetyl-N-[2-(azepan-1-yl)phenyl]-3,5-dimethyl-1H-pyrrole-2-carboxamide CAS Name: 4-acetyl-N-[2-(1-azepanyl)phenyl]-3,5-dimethyl-1H-pyrrole-2-carboxamide IUPAC Name: 4-acetyl-N-[2-(azepan-1-yl)phenyl]-3,5-dimethyl-1H-pyrrole-2-carboxamide Traditional Name: 4-acetyl-N-[2-(azepan-1-yl)phenyl]-3,5-dimethyl-1H-pyrrole-2-carboxamide Formula: C21H27N3O2 MolecularWeight: 353.45798

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)C)C)C(=O)NC2=CC=CC=C2N3CCCCCC3

Isomeric SMILES

CC1=C(NC(=C1C(=O)C)C)C(=O)NC2=CC=CC=C2N3CCCCCC3

InChI

InChI=1S/C21H27N3O2/c1-14-19(16(3)25)15(2)22-20(14)21(26)23-17-10-6-7-11-18(17)24-12-8-4-5-9-13-24/h6-7,10-11,22H,4-5,8-9,12-13H2,1-3H3,(H,23,26)