ethyl 4-[2-(4-methylsulfonylpiperazin-1-yl)ethanoylamino]benzoate

Systemtic Name: ethyl 4-[2-(4-methylsulfonylpiperazin-1-yl)ethanoylamino]benzoate Openeye Name: ethyl 4-[[2-(4-methylsulfonylpiperazin-1-yl)acetyl]amino]benzoate CAS Name: 4-[[2-(4-methylsulfonyl-1-piperazinyl)-1-oxoethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[2-(4-methylsulfonylpiperazin-1-yl)acetyl]amino]benzoate Traditional Name: 4-[[2-(4-mesylpiperazino)acetyl]amino]benzoic acid ethyl ester Formula: C16H23N3O5S MolecularWeight: 369.43592

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)CN2CCN(CC2)S(=O)(=O)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)CN2CCN(CC2)S(=O)(=O)C

InChI

InChI=1S/C16H23N3O5S/c1-3-24-16(21)13-4-6-14(7-5-13)17-15(20)12-18-8-10-19(11-9-18)25(2,22)23/h4-7H,3,8-12H2,1-2H3,(H,17,20)