4-[(3-ethoxy-4-methoxy-phenyl)methyl]-1-(phenylmethyl)-6-(pyridin-2-ylmethoxy)-1,4-diazepan-2-one

Systemtic Name: 4-[(3-ethoxy-4-methoxy-phenyl)methyl]-1-(phenylmethyl)-6-(pyridin-2-ylmethoxy)-1,4-diazepan-2-one Openeye Name: 1-benzyl-4-[(3-ethoxy-4-methoxy-phenyl)methyl]-6-(2-pyridylmethoxy)-1,4-diazepan-2-one CAS Name: 4-[(3-ethoxy-4-methoxyphenyl)methyl]-1-(phenylmethyl)-6-(2-pyridinylmethoxy)-1,4-diazepan-2-one IUPAC Name: 1-benzyl-4-[(3-ethoxy-4-methoxyphenyl)methyl]-6-(pyridin-2-ylmethoxy)-1,4-diazepan-2-one Traditional Name: 1-benzyl-4-(3-ethoxy-4-methoxy-benzyl)-6-(2-pyridylmethoxy)-1,4-diazepan-2-one Formula: C28H33N3O4 MolecularWeight: 475.57932

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)CN2CC(CN(C(=O)C2)CC3=CC=CC=C3)OCC4=CC=CC=N4)OC

Isomeric SMILES

CCOC1=C(C=CC(=C1)CN2CC(CN(C(=O)C2)CC3=CC=CC=C3)OCC4=CC=CC=N4)OC

InChI

InChI=1S/C28H33N3O4/c1-3-34-27-15-23(12-13-26(27)33-2)16-30-18-25(35-21-24-11-7-8-14-29-24)19-31(28(32)20-30)17-22-9-5-4-6-10-22/h4-15,25H,3,16-21H2,1-2H3