1-[(4-methoxyphenyl)-(4-phenylmethoxyphenyl)methyl]-1,4-diazepane

Systemtic Name: 1-[(4-methoxyphenyl)-(4-phenylmethoxyphenyl)methyl]-1,4-diazepane Openeye Name: 1-[(4-benzyloxyphenyl)-(4-methoxyphenyl)methyl]-1,4-diazepane CAS Name: 1-[(4-methoxyphenyl)-(4-phenylmethoxyphenyl)methyl]-1,4-diazepane IUPAC Name: 1-[(4-methoxyphenyl)-(4-phenylmethoxyphenyl)methyl]-1,4-diazepane Traditional Name: 1-[(4-benzoxyphenyl)-(4-methoxyphenyl)methyl]-1,4-diazepane Formula: C26H30N2O2 MolecularWeight: 402.5286

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(C2=CC=C(C=C2)OCC3=CC=CC=C3)N4CCCNCC4

Isomeric SMILES

COC1=CC=C(C=C1)C(C2=CC=C(C=C2)OCC3=CC=CC=C3)N4CCCNCC4

InChI

InChI=1S/C26H30N2O2/c1-29-24-12-8-22(9-13-24)26(28-18-5-16-27-17-19-28)23-10-14-25(15-11-23)30-20-21-6-3-2-4-7-21/h2-4,6-15,26-27H,5,16-20H2,1H3