2-[2-methoxy-6-[(4-methoxy-3-methyl-phenyl)carbamoyl]phenyl]selanylsulfanylbutanedioic acid

Systemtic Name: 2-[2-methoxy-6-[(4-methoxy-3-methyl-phenyl)carbamoyl]phenyl]selanylsulfanylbutanedioic acid Openeye Name: 2-[2-methoxy-6-[(4-methoxy-3-methyl-phenyl)carbamoyl]phenyl]selanylsulfanylbutanedioic acid CAS Name: 2-[[[2-methoxy-6-[(4-methoxy-3-methylanilino)-oxomethyl]phenyl]seleno]thio]butanedioic acid IUPAC Name: 2-[2-methoxy-6-[(4-methoxy-3-methylphenyl)carbamoyl]phenyl]selanylsulfanylbutanedioic acid Traditional Name: 2-[[[2-methoxy-6-[(4-methoxy-3-methyl-phenyl)carbamoyl]phenyl]seleno]thio]succinic acid Formula: C20H21NO7SSe MolecularWeight: 498.40824

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)C2=C(C(=CC=C2)OC)[Se]SC(CC(=O)O)C(=O)O)OC

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)C2=C(C(=CC=C2)OC)[Se]SC(CC(=O)O)C(=O)O)OC

InChI

InChI=1S/C20H21NO7SSe/c1-11-9-12(7-8-14(11)27-2)21-19(24)13-5-4-6-15(28-3)18(13)30-29-16(20(25)26)10-17(22)23/h4-9,16H,10H2,1-3H3,(H,21,24)(H,22,23)(H,25,26)