1-[(4-ethoxy-3-methoxy-phenyl)-(2-methylphenyl)methyl]-1,4-diazepane

Systemtic Name: 1-[(4-ethoxy-3-methoxy-phenyl)-(2-methylphenyl)methyl]-1,4-diazepane Openeye Name: 1-[(4-ethoxy-3-methoxy-phenyl)-(o-tolyl)methyl]-1,4-diazepane CAS Name: 1-[(4-ethoxy-3-methoxyphenyl)-(2-methylphenyl)methyl]-1,4-diazepane IUPAC Name: 1-[(4-ethoxy-3-methoxyphenyl)-(2-methylphenyl)methyl]-1,4-diazepane Traditional Name: 1-[(4-ethoxy-3-methoxy-phenyl)-(o-tolyl)methyl]-1,4-diazepane Formula: C22H30N2O2 MolecularWeight: 354.4858

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(C2=CC=CC=C2C)N3CCCNCC3)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(C2=CC=CC=C2C)N3CCCNCC3)OC

InChI

InChI=1S/C22H30N2O2/c1-4-26-20-11-10-18(16-21(20)25-3)22(19-9-6-5-8-17(19)2)24-14-7-12-23-13-15-24/h5-6,8-11,16,22-23H,4,7,12-15H2,1-3H3