2-[[3,4-bis(oxidanyl)-9,10-bis(oxidanylidene)anthracen-2-yl]methyl-(carboxymethyl)amino]ethanoic acid

Systemtic Name: 2-[[3,4-bis(oxidanyl)-9,10-bis(oxidanylidene)anthracen-2-yl]methyl-(carboxymethyl)amino]ethanoic acid Openeye Name: 2-[carboxymethyl-[(3,4-dihydroxy-9,10-dioxo-2-anthryl)methyl]amino]acetic acid CAS Name: 2-[carboxymethyl-[(3,4-dihydroxy-9,10-dioxo-2-anthracenyl)methyl]amino]acetic acid IUPAC Name: 2-[carboxymethyl-[(3,4-dihydroxy-9,10-dioxoanthracen-2-yl)methyl]amino]acetic acid Traditional Name: 2-[carboxymethyl-[(3,4-dihydroxy-9,10-diketo-2-anthryl)methyl]amino]acetic acid Formula: C19H15NO8 MolecularWeight: 385.3243

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)C3=CC(=C(C(=C3C2=O)O)O)CN(CC(=O)O)CC(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)C3=CC(=C(C(=C3C2=O)O)O)CN(CC(=O)O)CC(=O)O

InChI

InChI=1S/C19H15NO8/c21-13(22)7-20(8-14(23)24)6-9-5-12-15(19(28)16(9)25)18(27)11-4-2-1-3-10(11)17(12)26/h1-5,25,28H,6-8H2,(H,21,22)(H,23,24)