2-[2-methoxy-6-[(4-methoxy-2-nitro-phenyl)carbamoyl]phenyl]selanylsulfanylbutanedioic acid

Systemtic Name: 2-[2-methoxy-6-[(4-methoxy-2-nitro-phenyl)carbamoyl]phenyl]selanylsulfanylbutanedioic acid Openeye Name: 2-[2-methoxy-6-[(4-methoxy-2-nitro-phenyl)carbamoyl]phenyl]selanylsulfanylbutanedioic acid CAS Name: 2-[[[2-methoxy-6-[(4-methoxy-2-nitroanilino)-oxomethyl]phenyl]seleno]thio]butanedioic acid IUPAC Name: 2-[2-methoxy-6-[(4-methoxy-2-nitrophenyl)carbamoyl]phenyl]selanylsulfanylbutanedioic acid Traditional Name: 2-[[[2-methoxy-6-[(4-methoxy-2-nitro-phenyl)carbamoyl]phenyl]seleno]thio]succinic acid Formula: C19H18N2O9SSe MolecularWeight: 529.37922

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)NC(=O)C2=C(C(=CC=C2)OC)[Se]SC(CC(=O)O)C(=O)O)[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=C(C=C1)NC(=O)C2=C(C(=CC=C2)OC)[Se]SC(CC(=O)O)C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C19H18N2O9SSe/c1-29-10-6-7-12(13(8-10)21(27)28)20-18(24)11-4-3-5-14(30-2)17(11)32-31-15(19(25)26)9-16(22)23/h3-8,15H,9H2,1-2H3,(H,20,24)(H,22,23)(H,25,26)