[2-(1,3-benzodioxol-5-ylamino)-2-oxidanylidene-ethyl] 4-[1,3-bis(oxidanylidene)benzo[de]isoquinolin-2-yl]benzoate

Systemtic Name: [2-(1,3-benzodioxol-5-ylamino)-2-oxidanylidene-ethyl] 4-[1,3-bis(oxidanylidene)benzo[de]isoquinolin-2-yl]benzoate Openeye Name: [2-(1,3-benzodioxol-5-ylamino)-2-oxo-ethyl] 4-(1,3-dioxobenzo[de]isoquinolin-2-yl)benzoate CAS Name: 4-(1,3-dioxo-2-benzo[de]isoquinolinyl)benzoic acid [2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl] ester IUPAC Name: [2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl] 4-(1,3-dioxobenzo[de]isoquinolin-2-yl)benzoate Traditional Name: 4-(1,3-diketobenzo[de]isoquinolin-2-yl)benzoic acid [2-(1,3-benzodioxol-5-ylamino)-2-keto-ethyl] ester Formula: C28H18N2O7 MolecularWeight: 494.45172

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)NC(=O)COC(=O)C3=CC=C(C=C3)N4C(=O)C5=CC=CC6=C5C(=CC=C6)C4=O

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)NC(=O)COC(=O)C3=CC=C(C=C3)N4C(=O)C5=CC=CC6=C5C(=CC=C6)C4=O

InChI

InChI=1S/C28H18N2O7/c31-24(29-18-9-12-22-23(13-18)37-15-36-22)14-35-28(34)17-7-10-19(11-8-17)30-26(32)20-5-1-3-16-4-2-6-21(25(16)20)27(30)33/h1-13H,14-15H2,(H,29,31)