[2-(2-methylpropylamino)-2-oxidanylidene-ethyl] 4-[(3,4-dimethylphenyl)sulfonylamino]butanoate

Systemtic Name: [2-(2-methylpropylamino)-2-oxidanylidene-ethyl] 4-[(3,4-dimethylphenyl)sulfonylamino]butanoate Openeye Name: [2-(isobutylamino)-2-oxo-ethyl] 4-[(3,4-dimethylphenyl)sulfonylamino]butanoate CAS Name: 4-[(3,4-dimethylphenyl)sulfonylamino]butanoic acid [2-(2-methylpropylamino)-2-oxoethyl] ester IUPAC Name: [2-(2-methylpropylamino)-2-oxoethyl] 4-[(3,4-dimethylphenyl)sulfonylamino]butanoate Traditional Name: 4-[(3,4-dimethylphenyl)sulfonylamino]butyric acid [2-(isobutylamino)-2-keto-ethyl] ester Formula: C18H28N2O5S MolecularWeight: 384.49032

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NCCCC(=O)OCC(=O)NCC(C)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)NCCCC(=O)OCC(=O)NCC(C)C)C

InChI

InChI=1S/C18H28N2O5S/c1-13(2)11-19-17(21)12-25-18(22)6-5-9-20-26(23,24)16-8-7-14(3)15(4)10-16/h7-8,10,13,20H,5-6,9,11-12H2,1-4H3,(H,19,21)