3-[4-(2-methoxy-5-methyl-phenyl)sulfonylpiperazin-1-yl]-3-oxidanylidene-propanoic acid

Systemtic Name: 3-[4-(2-methoxy-5-methyl-phenyl)sulfonylpiperazin-1-yl]-3-oxidanylidene-propanoic acid Openeye Name: 3-[4-(2-methoxy-5-methyl-phenyl)sulfonylpiperazin-1-yl]-3-oxo-propanoic acid CAS Name: 3-[4-(2-methoxy-5-methylphenyl)sulfonyl-1-piperazinyl]-3-oxopropanoic acid IUPAC Name: 3-[4-(2-methoxy-5-methylphenyl)sulfonylpiperazin-1-yl]-3-oxopropanoic acid Traditional Name: 3-keto-3-[4-(2-methoxy-5-methyl-phenyl)sulfonylpiperazino]propionic acid Formula: C15H20N2O6S MolecularWeight: 356.3941

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)S(=O)(=O)N2CCN(CC2)C(=O)CC(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1)OC)S(=O)(=O)N2CCN(CC2)C(=O)CC(=O)O

InChI

InChI=1S/C15H20N2O6S/c1-11-3-4-12(23-2)13(9-11)24(21,22)17-7-5-16(6-8-17)14(18)10-15(19)20/h3-4,9H,5-8,10H2,1-2H3,(H,19,20)