2-[methyl-(4-pyrrolidin-1-ylsulfonylphenyl)carbonyl-amino]ethanoic acid

Systemtic Name: 2-[methyl-(4-pyrrolidin-1-ylsulfonylphenyl)carbonyl-amino]ethanoic acid Openeye Name: 2-[methyl-(4-pyrrolidin-1-ylsulfonylbenzoyl)amino]acetic acid CAS Name: 2-[methyl-[oxo-[4-(1-pyrrolidinylsulfonyl)phenyl]methyl]amino]acetic acid IUPAC Name: 2-[methyl-(4-pyrrolidin-1-ylsulfonylbenzoyl)amino]acetic acid Traditional Name: 2-[methyl-(4-pyrrolidinosulfonylbenzoyl)amino]acetic acid Formula: C14H18N2O5S MolecularWeight: 326.36812

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)O)C(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCCC2

Isomeric SMILES

CN(CC(=O)O)C(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCCC2

InChI

InChI=1S/C14H18N2O5S/c1-15(10-13(17)18)14(19)11-4-6-12(7-5-11)22(20,21)16-8-2-3-9-16/h4-7H,2-3,8-10H2,1H3,(H,17,18)