methyl 3-(3-azanylpiperidin-1-yl)sulfonylbenzoate

Systemtic Name: methyl 3-(3-azanylpiperidin-1-yl)sulfonylbenzoate Openeye Name: methyl 3-[(3-amino-1-piperidyl)sulfonyl]benzoate CAS Name: 3-[(3-amino-1-piperidinyl)sulfonyl]benzoic acid methyl ester IUPAC Name: methyl 3-(3-aminopiperidin-1-yl)sulfonylbenzoate Traditional Name: 3-(3-aminopiperidino)sulfonylbenzoic acid methyl ester Formula: C13H18N2O4S MolecularWeight: 298.35802

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)S(=O)(=O)N2CCCC(C2)N

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)S(=O)(=O)N2CCCC(C2)N

InChI

InChI=1S/C13H18N2O4S/c1-19-13(16)10-4-2-6-12(8-10)20(17,18)15-7-3-5-11(14)9-15/h2,4,6,8,11H,3,5,7,9,14H2,1H3