6-[(3-methoxyphenyl)methoxy]-1-phenethyl-4-(pyridin-3-ylmethyl)-1,4-diazepan-2-one

Systemtic Name: 6-[(3-methoxyphenyl)methoxy]-1-phenethyl-4-(pyridin-3-ylmethyl)-1,4-diazepan-2-one Openeye Name: 6-[(3-methoxyphenyl)methoxy]-1-phenethyl-4-(3-pyridylmethyl)-1,4-diazepan-2-one CAS Name: 6-[(3-methoxyphenyl)methoxy]-1-phenethyl-4-(3-pyridinylmethyl)-1,4-diazepan-2-one IUPAC Name: 6-[(3-methoxyphenyl)methoxy]-1-phenethyl-4-(pyridin-3-ylmethyl)-1,4-diazepan-2-one Traditional Name: 6-m-anisyloxy-1-phenethyl-4-(3-pyridylmethyl)-1,4-diazepan-2-one Formula: C27H31N3O3 MolecularWeight: 445.55334

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)COC2CN(CC(=O)N(C2)CCC3=CC=CC=C3)CC4=CN=CC=C4

Isomeric SMILES

COC1=CC=CC(=C1)COC2CN(CC(=O)N(C2)CCC3=CC=CC=C3)CC4=CN=CC=C4

InChI

InChI=1S/C27H31N3O3/c1-32-25-11-5-9-23(15-25)21-33-26-18-29(17-24-10-6-13-28-16-24)20-27(31)30(19-26)14-12-22-7-3-2-4-8-22/h2-11,13,15-16,26H,12,14,17-21H2,1H3