1-[furan-2-yl-(3-methylphenyl)methyl]-1,4-diazepane

Systemtic Name: 1-[furan-2-yl-(3-methylphenyl)methyl]-1,4-diazepane Openeye Name: 1-[2-furyl(m-tolyl)methyl]-1,4-diazepane CAS Name: 1-[2-furanyl-(3-methylphenyl)methyl]-1,4-diazepane IUPAC Name: 1-[furan-2-yl-(3-methylphenyl)methyl]-1,4-diazepane Traditional Name: 1-[2-furyl(m-tolyl)methyl]-1,4-diazepane Formula: C17H22N2O MolecularWeight: 270.36938

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)C(C2=CC=CO2)N3CCCNCC3

Isomeric SMILES

CC1=CC(=CC=C1)C(C2=CC=CO2)N3CCCNCC3

InChI

InChI=1S/C17H22N2O/c1-14-5-2-6-15(13-14)17(16-7-3-12-20-16)19-10-4-8-18-9-11-19/h2-3,5-7,12-13,17-18H,4,8-11H2,1H3