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

Systemtic Name: 1-[(3-chlorophenyl)-(3-phenoxyphenyl)methyl]-1,4-diazepane Openeye Name: 1-[(3-chlorophenyl)-(3-phenoxyphenyl)methyl]-1,4-diazepane CAS Name: 1-[(3-chlorophenyl)-(3-phenoxyphenyl)methyl]-1,4-diazepane IUPAC Name: 1-[(3-chlorophenyl)-(3-phenoxyphenyl)methyl]-1,4-diazepane Traditional Name: 1-[(3-chlorophenyl)-(3-phenoxyphenyl)methyl]-1,4-diazepane Formula: C24H25ClN2O MolecularWeight: 392.9211

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCN(C1)C(C2=CC(=CC=C2)OC3=CC=CC=C3)C4=CC(=CC=C4)Cl

Isomeric SMILES

C1CNCCN(C1)C(C2=CC(=CC=C2)OC3=CC=CC=C3)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C24H25ClN2O/c25-21-9-4-7-19(17-21)24(27-15-6-13-26-14-16-27)20-8-5-12-23(18-20)28-22-10-2-1-3-11-22/h1-5,7-12,17-18,24,26H,6,13-16H2