[2-(3-methylbutylcarbamoylamino)-2-oxidanylidene-ethyl] 2-methoxy-5-sulfamoyl-benzoate

Systemtic Name: [2-(3-methylbutylcarbamoylamino)-2-oxidanylidene-ethyl] 2-methoxy-5-sulfamoyl-benzoate Openeye Name: [2-(isopentylcarbamoylamino)-2-oxo-ethyl] 2-methoxy-5-sulfamoyl-benzoate CAS Name: 2-methoxy-5-sulfamoylbenzoic acid [2-[[(3-methylbutylamino)-oxomethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-(3-methylbutylcarbamoylamino)-2-oxoethyl] 2-methoxy-5-sulfamoylbenzoate Traditional Name: 2-methoxy-5-sulfamoyl-benzoic acid [2-(isoamylcarbamoylamino)-2-keto-ethyl] ester Formula: C16H23N3O7S MolecularWeight: 401.43472

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)NC(=O)COC(=O)C1=C(C=CC(=C1)S(=O)(=O)N)OC

Isomeric SMILES

CC(C)CCNC(=O)NC(=O)COC(=O)C1=C(C=CC(=C1)S(=O)(=O)N)OC

InChI

InChI=1S/C16H23N3O7S/c1-10(2)6-7-18-16(22)19-14(20)9-26-15(21)12-8-11(27(17,23)24)4-5-13(12)25-3/h4-5,8,10H,6-7,9H2,1-3H3,(H2,17,23,24)(H2,18,19,20,22)