2-[1-aminocarbonyl-9,10-bis(oxidanylidene)anthracen-2-yl]sulfanylethanoate

Systemtic Name: 2-[1-aminocarbonyl-9,10-bis(oxidanylidene)anthracen-2-yl]sulfanylethanoate Openeye Name: 2-[(1-carbamoyl-9,10-dioxo-2-anthryl)sulfanyl]acetate CAS Name: 2-[(1-carbamoyl-9,10-dioxo-2-anthracenyl)thio]acetate IUPAC Name: 2-(1-carbamoyl-9,10-dioxoanthracen-2-yl)sulfanylacetate Traditional Name: 2-[(1-carbamoyl-9,10-diketo-2-anthryl)thio]acetate Formula: C17H10NO5S- MolecularWeight: 340.33

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3)SCC(=O)[O-])C(=O)N

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3)SCC(=O)[O-])C(=O)N

InChI

InChI=1S/C17H11NO5S/c18-17(23)14-11(24-7-12(19)20)6-5-10-13(14)16(22)9-4-2-1-3-8(9)15(10)21/h1-6H,7H2,(H2,18,23)(H,19,20)/p-1