3-(4-methyl-3-pyrrolidin-1-ylsulfonyl-phenyl)propanoate

Systemtic Name: 3-(4-methyl-3-pyrrolidin-1-ylsulfonyl-phenyl)propanoate Openeye Name: 3-(4-methyl-3-pyrrolidin-1-ylsulfonyl-phenyl)propanoate CAS Name: 3-[4-methyl-3-(1-pyrrolidinylsulfonyl)phenyl]propanoate IUPAC Name: 3-(4-methyl-3-pyrrolidin-1-ylsulfonylphenyl)propanoate Traditional Name: 3-(4-methyl-3-pyrrolidinosulfonyl-phenyl)propionate Formula: C14H18NO4S- MolecularWeight: 296.36202

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)CCC(=O)[O-])S(=O)(=O)N2CCCC2

Isomeric SMILES

CC1=C(C=C(C=C1)CCC(=O)[O-])S(=O)(=O)N2CCCC2

InChI

InChI=1S/C14H19NO4S/c1-11-4-5-12(6-7-14(16)17)10-13(11)20(18,19)15-8-2-3-9-15/h4-5,10H,2-3,6-9H2,1H3,(H,16,17)/p-1