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

Systemtic Name: 1-[(2,5-dimethoxyphenyl)-(4-phenylphenyl)methyl]-1,4-diazepane Openeye Name: 1-[(2,5-dimethoxyphenyl)-(4-phenylphenyl)methyl]-1,4-diazepane CAS Name: 1-[(2,5-dimethoxyphenyl)-(4-phenylphenyl)methyl]-1,4-diazepane IUPAC Name: 1-[(2,5-dimethoxyphenyl)-(4-phenylphenyl)methyl]-1,4-diazepane Traditional Name: 1-[(2,5-dimethoxyphenyl)-(4-phenylphenyl)methyl]-1,4-diazepane Formula: C26H30N2O2 MolecularWeight: 402.5286

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)C(C2=CC=C(C=C2)C3=CC=CC=C3)N4CCCNCC4

Isomeric SMILES

COC1=CC(=C(C=C1)OC)C(C2=CC=C(C=C2)C3=CC=CC=C3)N4CCCNCC4

InChI

InChI=1S/C26H30N2O2/c1-29-23-13-14-25(30-2)24(19-23)26(28-17-6-15-27-16-18-28)22-11-9-21(10-12-22)20-7-4-3-5-8-20/h3-5,7-14,19,26-27H,6,15-18H2,1-2H3