azepan-1-yl-[5-(3,4-dimethylphenyl)-2-methyl-1H-pyrrol-3-yl]methanone

Systemtic Name: azepan-1-yl-[5-(3,4-dimethylphenyl)-2-methyl-1H-pyrrol-3-yl]methanone Openeye Name: azepan-1-yl-[5-(3,4-dimethylphenyl)-2-methyl-1H-pyrrol-3-yl]methanone CAS Name: 1-azepanyl-[5-(3,4-dimethylphenyl)-2-methyl-1H-pyrrol-3-yl]methanone IUPAC Name: azepan-1-yl-[5-(3,4-dimethylphenyl)-2-methyl-1H-pyrrol-3-yl]methanone Traditional Name: azepan-1-yl-[5-(3,4-dimethylphenyl)-2-methyl-1H-pyrrol-3-yl]methanone Formula: C20H26N2O MolecularWeight: 310.43324

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=CC(=C(N2)C)C(=O)N3CCCCCC3)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=CC(=C(N2)C)C(=O)N3CCCCCC3)C

InChI

InChI=1S/C20H26N2O/c1-14-8-9-17(12-15(14)2)19-13-18(16(3)21-19)20(23)22-10-6-4-5-7-11-22/h8-9,12-13,21H,4-7,10-11H2,1-3H3