2-[(4-methoxycarbonylphenyl)sulfonylamino]butanedioic acid

Systemtic Name: 2-[(4-methoxycarbonylphenyl)sulfonylamino]butanedioic acid Openeye Name: 2-[(4-methoxycarbonylphenyl)sulfonylamino]butanedioic acid CAS Name: 2-[(4-methoxycarbonylphenyl)sulfonylamino]butanedioic acid IUPAC Name: 2-[(4-methoxycarbonylphenyl)sulfonylamino]butanedioic acid Traditional Name: 2-[(4-carbomethoxyphenyl)sulfonylamino]succinic acid Formula: C12H13NO8S MolecularWeight: 331.29852

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)S(=O)(=O)NC(CC(=O)O)C(=O)O

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)S(=O)(=O)NC(CC(=O)O)C(=O)O

InChI

InChI=1S/C12H13NO8S/c1-21-12(18)7-2-4-8(5-3-7)22(19,20)13-9(11(16)17)6-10(14)15/h2-5,9,13H,6H2,1H3,(H,14,15)(H,16,17)