methyl 4-[(4-methylsulfonylpiperazin-1-yl)carbonylamino]benzoate

Systemtic Name: methyl 4-[(4-methylsulfonylpiperazin-1-yl)carbonylamino]benzoate Openeye Name: methyl 4-[(4-methylsulfonylpiperazine-1-carbonyl)amino]benzoate CAS Name: 4-[[(4-methylsulfonyl-1-piperazinyl)-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[(4-methylsulfonylpiperazine-1-carbonyl)amino]benzoate Traditional Name: 4-[(4-mesylpiperazine-1-carbonyl)amino]benzoic acid methyl ester Formula: C14H19N3O5S MolecularWeight: 341.38276

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)NC(=O)N2CCN(CC2)S(=O)(=O)C

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)NC(=O)N2CCN(CC2)S(=O)(=O)C

InChI

InChI=1S/C14H19N3O5S/c1-22-13(18)11-3-5-12(6-4-11)15-14(19)16-7-9-17(10-8-16)23(2,20)21/h3-6H,7-10H2,1-2H3,(H,15,19)