1-[naphthalen-1-yl-(3-phenylmethoxyphenyl)methyl]-1,4-diazepane

Systemtic Name: 1-[naphthalen-1-yl-(3-phenylmethoxyphenyl)methyl]-1,4-diazepane Openeye Name: 1-[(3-benzyloxyphenyl)-(1-naphthyl)methyl]-1,4-diazepane CAS Name: 1-[1-naphthalenyl-(3-phenylmethoxyphenyl)methyl]-1,4-diazepane IUPAC Name: 1-[naphthalen-1-yl-(3-phenylmethoxyphenyl)methyl]-1,4-diazepane Traditional Name: 1-[(3-benzoxyphenyl)-(1-naphthyl)methyl]-1,4-diazepane Formula: C29H30N2O MolecularWeight: 422.5613

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCN(C1)C(C2=CC(=CC=C2)OCC3=CC=CC=C3)C4=CC=CC5=CC=CC=C54

Isomeric SMILES

C1CNCCN(C1)C(C2=CC(=CC=C2)OCC3=CC=CC=C3)C4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C29H30N2O/c1-2-9-23(10-3-1)22-32-26-14-6-13-25(21-26)29(31-19-8-17-30-18-20-31)28-16-7-12-24-11-4-5-15-27(24)28/h1-7,9-16,21,29-30H,8,17-20,22H2