(4-heptylphenyl)-(4-methyl-1,4-diazepan-1-yl)methanone

Systemtic Name: (4-heptylphenyl)-(4-methyl-1,4-diazepan-1-yl)methanone Openeye Name: (4-heptylphenyl)-(4-methyl-1,4-diazepan-1-yl)methanone CAS Name: (4-heptylphenyl)-(4-methyl-1,4-diazepan-1-yl)methanone IUPAC Name: (4-heptylphenyl)-(4-methyl-1,4-diazepan-1-yl)methanone Traditional Name: (4-heptylphenyl)-(4-methyl-1,4-diazepan-1-yl)methanone Formula: C20H32N2O MolecularWeight: 316.48088

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CC=C(C=C1)C(=O)N2CCCN(CC2)C

Isomeric SMILES

CCCCCCCC1=CC=C(C=C1)C(=O)N2CCCN(CC2)C

InChI

InChI=1S/C20H32N2O/c1-3-4-5-6-7-9-18-10-12-19(13-11-18)20(23)22-15-8-14-21(2)16-17-22/h10-13H,3-9,14-17H2,1-2H3