4-(oxan-4-yl)-6-phenylmethoxy-1-(pyridin-3-ylmethyl)-1,4-diazepan-2-one

Systemtic Name: 4-(oxan-4-yl)-6-phenylmethoxy-1-(pyridin-3-ylmethyl)-1,4-diazepan-2-one Openeye Name: 6-benzyloxy-1-(3-pyridylmethyl)-4-tetrahydropyran-4-yl-1,4-diazepan-2-one CAS Name: 4-(4-oxanyl)-6-phenylmethoxy-1-(3-pyridinylmethyl)-1,4-diazepan-2-one IUPAC Name: 4-(oxan-4-yl)-6-phenylmethoxy-1-(pyridin-3-ylmethyl)-1,4-diazepan-2-one Traditional Name: 6-benzoxy-1-(3-pyridylmethyl)-4-tetrahydropyran-4-yl-1,4-diazepan-2-one Formula: C23H29N3O3 MolecularWeight: 395.49466

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCC1N2CC(CN(C(=O)C2)CC3=CN=CC=C3)OCC4=CC=CC=C4

Isomeric SMILES

C1COCCC1N2CC(CN(C(=O)C2)CC3=CN=CC=C3)OCC4=CC=CC=C4

InChI

InChI=1S/C23H29N3O3/c27-23-17-25(21-8-11-28-12-9-21)15-22(29-18-19-5-2-1-3-6-19)16-26(23)14-20-7-4-10-24-13-20/h1-7,10,13,21-22H,8-9,11-12,14-18H2