4-[2-(3,4-dimethoxyphenyl)-2-oxidanylidene-ethyl]-2-methyl-1,4-benzoxazepine-3,5-dione

Systemtic Name: 4-[2-(3,4-dimethoxyphenyl)-2-oxidanylidene-ethyl]-2-methyl-1,4-benzoxazepine-3,5-dione Openeye Name: 4-[2-(3,4-dimethoxyphenyl)-2-oxo-ethyl]-2-methyl-1,4-benzoxazepine-3,5-dione CAS Name: 4-[2-(3,4-dimethoxyphenyl)-2-oxoethyl]-2-methyl-1,4-benzoxazepine-3,5-dione IUPAC Name: 4-[2-(3,4-dimethoxyphenyl)-2-oxoethyl]-2-methyl-1,4-benzoxazepine-3,5-dione Traditional Name: 4-[2-(3,4-dimethoxyphenyl)-2-keto-ethyl]-2-methyl-1,4-benzoxazepine-3,5-quinone Formula: C20H19NO6 MolecularWeight: 369.36796

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)N(C(=O)C2=CC=CC=C2O1)CC(=O)C3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CC1C(=O)N(C(=O)C2=CC=CC=C2O1)CC(=O)C3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C20H19NO6/c1-12-19(23)21(20(24)14-6-4-5-7-16(14)27-12)11-15(22)13-8-9-17(25-2)18(10-13)26-3/h4-10,12H,11H2,1-3H3