3-cyclohexa-1,3-dien-1-ylcarbonyl-2-(3,4-dimethoxyphenyl)-2H-1,3-benzoxazin-4-one

Systemtic Name: 3-cyclohexa-1,3-dien-1-ylcarbonyl-2-(3,4-dimethoxyphenyl)-2H-1,3-benzoxazin-4-one Openeye Name: 3-(cyclohexa-1,3-diene-1-carbonyl)-2-(3,4-dimethoxyphenyl)-2H-1,3-benzoxazin-4-one CAS Name: 3-[1-cyclohexa-1,3-dienyl(oxo)methyl]-2-(3,4-dimethoxyphenyl)-2H-1,3-benzoxazin-4-one IUPAC Name: 3-(cyclohexa-1,3-diene-1-carbonyl)-2-(3,4-dimethoxyphenyl)-2H-1,3-benzoxazin-4-one Traditional Name: 3-(cyclohexa-1,3-diene-1-carbonyl)-2-(3,4-dimethoxyphenyl)-2H-1,3-benzoxazin-4-one Formula: C23H21NO5 MolecularWeight: 391.41654

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2N(C(=O)C3=CC=CC=C3O2)C(=O)C4=CC=CCC4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2N(C(=O)C3=CC=CC=C3O2)C(=O)C4=CC=CCC4)OC

InChI

InChI=1S/C23H21NO5/c1-27-19-13-12-16(14-20(19)28-2)23-24(21(25)15-8-4-3-5-9-15)22(26)17-10-6-7-11-18(17)29-23/h3-4,6-8,10-14,23H,5,9H2,1-2H3