1-[(3,5-dimethoxy-4-phenylmethoxy-phenyl)-(4-phenylphenyl)methyl]-1,4-diazepane

Systemtic Name: 1-[(3,5-dimethoxy-4-phenylmethoxy-phenyl)-(4-phenylphenyl)methyl]-1,4-diazepane Openeye Name: 1-[(4-benzyloxy-3,5-dimethoxy-phenyl)-(4-phenylphenyl)methyl]-1,4-diazepane CAS Name: 1-[(3,5-dimethoxy-4-phenylmethoxyphenyl)-(4-phenylphenyl)methyl]-1,4-diazepane IUPAC Name: 1-[(3,5-dimethoxy-4-phenylmethoxyphenyl)-(4-phenylphenyl)methyl]-1,4-diazepane Traditional Name: 1-[(4-benzoxy-3,5-dimethoxy-phenyl)-(4-phenylphenyl)methyl]-1,4-diazepane Formula: C33H36N2O3 MolecularWeight: 508.65054

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OCC2=CC=CC=C2)OC)C(C3=CC=C(C=C3)C4=CC=CC=C4)N5CCCNCC5

Isomeric SMILES

COC1=CC(=CC(=C1OCC2=CC=CC=C2)OC)C(C3=CC=C(C=C3)C4=CC=CC=C4)N5CCCNCC5

InChI

InChI=1S/C33H36N2O3/c1-36-30-22-29(23-31(37-2)33(30)38-24-25-10-5-3-6-11-25)32(35-20-9-18-34-19-21-35)28-16-14-27(15-17-28)26-12-7-4-8-13-26/h3-8,10-17,22-23,32,34H,9,18-21,24H2,1-2H3