1-[(3-methoxyphenyl)-(3-phenoxyphenyl)methyl]-1,4-diazepane

Systemtic Name: 1-[(3-methoxyphenyl)-(3-phenoxyphenyl)methyl]-1,4-diazepane Openeye Name: 1-[(3-methoxyphenyl)-(3-phenoxyphenyl)methyl]-1,4-diazepane CAS Name: 1-[(3-methoxyphenyl)-(3-phenoxyphenyl)methyl]-1,4-diazepane IUPAC Name: 1-[(3-methoxyphenyl)-(3-phenoxyphenyl)methyl]-1,4-diazepane Traditional Name: 1-[(3-methoxyphenyl)-(3-phenoxyphenyl)methyl]-1,4-diazepane Formula: C25H28N2O2 MolecularWeight: 388.50202

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(C2=CC(=CC=C2)OC3=CC=CC=C3)N4CCCNCC4

Isomeric SMILES

COC1=CC=CC(=C1)C(C2=CC(=CC=C2)OC3=CC=CC=C3)N4CCCNCC4

InChI

InChI=1S/C25H28N2O2/c1-28-23-12-5-8-20(18-23)25(27-16-7-14-26-15-17-27)21-9-6-13-24(19-21)29-22-10-3-2-4-11-22/h2-6,8-13,18-19,25-26H,7,14-17H2,1H3