1-[(2,5-dimethoxyphenyl)-(4-methylphenyl)methyl]-1,4-diazepane

Systemtic Name: 1-[(2,5-dimethoxyphenyl)-(4-methylphenyl)methyl]-1,4-diazepane Openeye Name: 1-[(2,5-dimethoxyphenyl)-(p-tolyl)methyl]-1,4-diazepane CAS Name: 1-[(2,5-dimethoxyphenyl)-(4-methylphenyl)methyl]-1,4-diazepane IUPAC Name: 1-[(2,5-dimethoxyphenyl)-(4-methylphenyl)methyl]-1,4-diazepane Traditional Name: 1-[(2,5-dimethoxyphenyl)-(p-tolyl)methyl]-1,4-diazepane Formula: C21H28N2O2 MolecularWeight: 340.45922

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H28N2O2/c1-16-5-7-17(8-6-16)21(23-13-4-11-22-12-14-23)19-15-18(24-2)9-10-20(19)25-3/h5-10,15,21-22H,4,11-14H2,1-3H3