4-[6-(2-hydroxyethylamino)-1,3-bis(oxidanylidene)benzo[de]isoquinolin-2-yl]benzoic acid

Systemtic Name: 4-[6-(2-hydroxyethylamino)-1,3-bis(oxidanylidene)benzo[de]isoquinolin-2-yl]benzoic acid Openeye Name: 4-[6-(2-hydroxyethylamino)-1,3-dioxo-benzo[de]isoquinolin-2-yl]benzoic acid CAS Name: 4-[6-(2-hydroxyethylamino)-1,3-dioxo-2-benzo[de]isoquinolinyl]benzoic acid IUPAC Name: 4-[6-(2-hydroxyethylamino)-1,3-dioxobenzo[de]isoquinolin-2-yl]benzoic acid Traditional Name: 4-[6-(2-hydroxyethylamino)-1,3-diketo-benzo[de]isoquinolin-2-yl]benzoic acid Formula: C21H16N2O5 MolecularWeight: 376.36214

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CC3=C2C(=C1)C(=O)N(C3=O)C4=CC=C(C=C4)C(=O)O)NCCO

Isomeric SMILES

C1=CC2=C(C=CC3=C2C(=C1)C(=O)N(C3=O)C4=CC=C(C=C4)C(=O)O)NCCO

InChI

InChI=1S/C21H16N2O5/c24-11-10-22-17-9-8-16-18-14(17)2-1-3-15(18)19(25)23(20(16)26)13-6-4-12(5-7-13)21(27)28/h1-9,22,24H,10-11H2,(H,27,28)