4-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)-6-methoxy-1-(pyridin-3-ylmethyl)-1,4-diazepan-2-one

Systemtic Name: 4-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)-6-methoxy-1-(pyridin-3-ylmethyl)-1,4-diazepan-2-one Openeye Name: 4-(2,3-dihydro-1,4-benzodioxine-6-carbonyl)-6-methoxy-1-(3-pyridylmethyl)-1,4-diazepan-2-one CAS Name: 4-[2,3-dihydro-1,4-benzodioxin-6-yl(oxo)methyl]-6-methoxy-1-(3-pyridinylmethyl)-1,4-diazepan-2-one IUPAC Name: 4-(2,3-dihydro-1,4-benzodioxine-6-carbonyl)-6-methoxy-1-(pyridin-3-ylmethyl)-1,4-diazepan-2-one Traditional Name: 4-(2,3-dihydro-1,4-benzodioxin-6-carbonyl)-6-methoxy-1-(3-pyridylmethyl)-1,4-diazepan-2-one Formula: C21H23N3O5 MolecularWeight: 397.42442

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Descriptors Computed from Structure

Canonical SMILES:

COC1CN(CC(=O)N(C1)CC2=CN=CC=C2)C(=O)C3=CC4=C(C=C3)OCCO4

Isomeric SMILES

COC1CN(CC(=O)N(C1)CC2=CN=CC=C2)C(=O)C3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C21H23N3O5/c1-27-17-12-23(11-15-3-2-6-22-10-15)20(25)14-24(13-17)21(26)16-4-5-18-19(9-16)29-8-7-28-18/h2-6,9-10,17H,7-8,11-14H2,1H3