4-[(3-methoxyphenyl)methyl]-1-(oxan-4-ylmethyl)-6-phenylmethoxy-1,4-diazepan-2-one

Systemtic Name: 4-[(3-methoxyphenyl)methyl]-1-(oxan-4-ylmethyl)-6-phenylmethoxy-1,4-diazepan-2-one Openeye Name: 6-benzyloxy-4-[(3-methoxyphenyl)methyl]-1-(tetrahydropyran-4-ylmethyl)-1,4-diazepan-2-one CAS Name: 4-[(3-methoxyphenyl)methyl]-1-(4-oxanylmethyl)-6-phenylmethoxy-1,4-diazepan-2-one IUPAC Name: 4-[(3-methoxyphenyl)methyl]-1-(oxan-4-ylmethyl)-6-phenylmethoxy-1,4-diazepan-2-one Traditional Name: 6-benzoxy-4-m-anisyl-1-(tetrahydropyran-4-ylmethyl)-1,4-diazepan-2-one Formula: C26H34N2O4 MolecularWeight: 438.55916

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CN2CC(CN(C(=O)C2)CC3CCOCC3)OCC4=CC=CC=C4

Isomeric SMILES

COC1=CC=CC(=C1)CN2CC(CN(C(=O)C2)CC3CCOCC3)OCC4=CC=CC=C4

InChI

InChI=1S/C26H34N2O4/c1-30-24-9-5-8-23(14-24)15-27-17-25(32-20-22-6-3-2-4-7-22)18-28(26(29)19-27)16-21-10-12-31-13-11-21/h2-9,14,21,25H,10-13,15-20H2,1H3