1-[(3-ethoxy-4-phenylmethoxy-phenyl)-phenyl-methyl]-1,4-diazepane

Systemtic Name: 1-[(3-ethoxy-4-phenylmethoxy-phenyl)-phenyl-methyl]-1,4-diazepane Openeye Name: 1-[(4-benzyloxy-3-ethoxy-phenyl)-phenyl-methyl]-1,4-diazepane CAS Name: 1-[(3-ethoxy-4-phenylmethoxyphenyl)-phenylmethyl]-1,4-diazepane IUPAC Name: 1-[(3-ethoxy-4-phenylmethoxyphenyl)-phenylmethyl]-1,4-diazepane Traditional Name: 1-[(4-benzoxy-3-ethoxy-phenyl)-phenyl-methyl]-1,4-diazepane Formula: C27H32N2O2 MolecularWeight: 416.55518

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C(C2=CC=CC=C2)N3CCCNCC3)OCC4=CC=CC=C4

Isomeric SMILES

CCOC1=C(C=CC(=C1)C(C2=CC=CC=C2)N3CCCNCC3)OCC4=CC=CC=C4

InChI

InChI=1S/C27H32N2O2/c1-2-30-26-20-24(14-15-25(26)31-21-22-10-5-3-6-11-22)27(23-12-7-4-8-13-23)29-18-9-16-28-17-19-29/h3-8,10-15,20,27-28H,2,9,16-19,21H2,1H3