2-methyl-3-[(3-nitrophenyl)amino]-2-(4-phenylphenyl)sulfonyl-thiomorpholine-3-carboxylic acid

Systemtic Name: 2-methyl-3-[(3-nitrophenyl)amino]-2-(4-phenylphenyl)sulfonyl-thiomorpholine-3-carboxylic acid Openeye Name: 2-methyl-3-(3-nitroanilino)-2-(4-phenylphenyl)sulfonyl-thiomorpholine-3-carboxylic acid CAS Name: 2-methyl-3-(3-nitroanilino)-2-(4-phenylphenyl)sulfonyl-3-thiomorpholinecarboxylic acid IUPAC Name: 2-methyl-3-(3-nitroanilino)-2-(4-phenylphenyl)sulfonylthiomorpholine-3-carboxylic acid Traditional Name: 2-methyl-3-(3-nitroanilino)-2-(4-phenylphenyl)sulfonyl-thiomorpholine-3-carboxylic acid Formula: C24H23N3O6S2 MolecularWeight: 513.58592

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(NCCS1)(C(=O)O)NC2=CC(=CC=C2)[N+](=O)[O-])S(=O)(=O)C3=CC=C(C=C3)C4=CC=CC=C4

Isomeric SMILES

CC1(C(NCCS1)(C(=O)O)NC2=CC(=CC=C2)[N+](=O)[O-])S(=O)(=O)C3=CC=C(C=C3)C4=CC=CC=C4

InChI

InChI=1S/C24H23N3O6S2/c1-23(35(32,33)21-12-10-18(11-13-21)17-6-3-2-4-7-17)24(22(28)29,25-14-15-34-23)26-19-8-5-9-20(16-19)27(30)31/h2-13,16,25-26H,14-15H2,1H3,(H,28,29)