methyl 3-azanyl-4-pyrrolidin-1-ylsulfonyl-benzoate

Systemtic Name: methyl 3-azanyl-4-pyrrolidin-1-ylsulfonyl-benzoate Openeye Name: methyl 3-amino-4-pyrrolidin-1-ylsulfonyl-benzoate CAS Name: 3-amino-4-(1-pyrrolidinylsulfonyl)benzoic acid methyl ester IUPAC Name: methyl 3-amino-4-pyrrolidin-1-ylsulfonylbenzoate Traditional Name: 3-amino-4-pyrrolidinosulfonyl-benzoic acid methyl ester Formula: C12H16N2O4S MolecularWeight: 284.33144

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1)S(=O)(=O)N2CCCC2)N

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1)S(=O)(=O)N2CCCC2)N

InChI

InChI=1S/C12H16N2O4S/c1-18-12(15)9-4-5-11(10(13)8-9)19(16,17)14-6-2-3-7-14/h4-5,8H,2-3,6-7,13H2,1H3