[2-(ethylcarbamoylamino)-2-oxidanylidene-ethyl] 4-bromanyl-3-(4-methylpiperidin-1-yl)sulfonyl-benzoate

Systemtic Name: [2-(ethylcarbamoylamino)-2-oxidanylidene-ethyl] 4-bromanyl-3-(4-methylpiperidin-1-yl)sulfonyl-benzoate Openeye Name: [2-(ethylcarbamoylamino)-2-oxo-ethyl] 4-bromo-3-[(4-methyl-1-piperidyl)sulfonyl]benzoate CAS Name: 4-bromo-3-[(4-methyl-1-piperidinyl)sulfonyl]benzoic acid [2-(ethylcarbamoylamino)-2-oxoethyl] ester IUPAC Name: [2-(ethylcarbamoylamino)-2-oxoethyl] 4-bromo-3-(4-methylpiperidin-1-yl)sulfonylbenzoate Traditional Name: 4-bromo-3-(4-methylpiperidino)sulfonyl-benzoic acid [2-(ethylcarbamoylamino)-2-keto-ethyl] ester Formula: C18H24BrN3O6S MolecularWeight: 490.36866

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)NC(=O)COC(=O)C1=CC(=C(C=C1)Br)S(=O)(=O)N2CCC(CC2)C

Isomeric SMILES

CCNC(=O)NC(=O)COC(=O)C1=CC(=C(C=C1)Br)S(=O)(=O)N2CCC(CC2)C

InChI

InChI=1S/C18H24BrN3O6S/c1-3-20-18(25)21-16(23)11-28-17(24)13-4-5-14(19)15(10-13)29(26,27)22-8-6-12(2)7-9-22/h4-5,10,12H,3,6-9,11H2,1-2H3,(H2,20,21,23,25)