2-azanyl-4-(3-methoxyphenyl)-2-(4-methylphenyl)sulfonyl-butanoic acid

Systemtic Name: 2-azanyl-4-(3-methoxyphenyl)-2-(4-methylphenyl)sulfonyl-butanoic acid Openeye Name: 2-amino-4-(3-methoxyphenyl)-2-(p-tolylsulfonyl)butanoic acid CAS Name: 2-amino-4-(3-methoxyphenyl)-2-(4-methylphenyl)sulfonylbutanoic acid IUPAC Name: 2-amino-4-(3-methoxyphenyl)-2-(4-methylphenyl)sulfonylbutanoic acid Traditional Name: 2-amino-4-(3-methoxyphenyl)-2-tosyl-butyric acid Formula: C18H21NO5S MolecularWeight: 363.42804

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C(CCC2=CC(=CC=C2)OC)(C(=O)O)N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C(CCC2=CC(=CC=C2)OC)(C(=O)O)N

InChI

InChI=1S/C18H21NO5S/c1-13-6-8-16(9-7-13)25(22,23)18(19,17(20)21)11-10-14-4-3-5-15(12-14)24-2/h3-9,12H,10-11,19H2,1-2H3,(H,20,21)