ethyl 4-[4-[[2-(2,3-dihydro-1,4-benzodioxin-3-ylcarbonyl)hydrazinyl]methylidene]-1,3-bis(oxidanylidene)isoquinolin-2-yl]benzoate

Systemtic Name: ethyl 4-[4-[[2-(2,3-dihydro-1,4-benzodioxin-3-ylcarbonyl)hydrazinyl]methylidene]-1,3-bis(oxidanylidene)isoquinolin-2-yl]benzoate Openeye Name: ethyl 4-[4-[[2-(2,3-dihydro-1,4-benzodioxine-3-carbonyl)hydrazino]methylene]-1,3-dioxo-2-isoquinolyl]benzoate CAS Name: 4-[4-[[[2,3-dihydro-1,4-benzodioxin-3-yl(oxo)methyl]hydrazo]methylidene]-1,3-dioxo-2-isoquinolinyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[4-[[2-(2,3-dihydro-1,4-benzodioxine-3-carbonyl)hydrazinyl]methylidene]-1,3-dioxoisoquinolin-2-yl]benzoate Traditional Name: 4-[4-[[N'-(2,3-dihydro-1,4-benzodioxin-3-carbonyl)hydrazino]methylene]-1,3-diketo-2-isoquinolyl]benzoic acid ethyl ester Formula: C28H23N3O7 MolecularWeight: 513.49812

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3C(=CNNC(=O)C4COC5=CC=CC=C5O4)C2=O

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3C(=CNNC(=O)C4COC5=CC=CC=C5O4)C2=O

InChI

InChI=1S/C28H23N3O7/c1-2-36-28(35)17-11-13-18(14-12-17)31-26(33)20-8-4-3-7-19(20)21(27(31)34)15-29-30-25(32)24-16-37-22-9-5-6-10-23(22)38-24/h3-15,24,29H,2,16H2,1H3,(H,30,32)