[2-(6-methylheptan-2-ylamino)-2-oxidanylidene-ethyl] 3-[(3,4-dimethoxyphenyl)sulfonylamino]propanoate

Systemtic Name: [2-(6-methylheptan-2-ylamino)-2-oxidanylidene-ethyl] 3-[(3,4-dimethoxyphenyl)sulfonylamino]propanoate Openeye Name: [2-(1,5-dimethylhexylamino)-2-oxo-ethyl] 3-[(3,4-dimethoxyphenyl)sulfonylamino]propanoate CAS Name: 3-[(3,4-dimethoxyphenyl)sulfonylamino]propanoic acid [2-(6-methylheptan-2-ylamino)-2-oxoethyl] ester IUPAC Name: [2-(6-methylheptan-2-ylamino)-2-oxoethyl] 3-[(3,4-dimethoxyphenyl)sulfonylamino]propanoate Traditional Name: 3-[(3,4-dimethoxyphenyl)sulfonylamino]propionic acid [2-(1,5-dimethylhexylamino)-2-keto-ethyl] ester Formula: C21H34N2O7S MolecularWeight: 458.56886

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCC(C)NC(=O)COC(=O)CCNS(=O)(=O)C1=CC(=C(C=C1)OC)OC

Isomeric SMILES

CC(C)CCCC(C)NC(=O)COC(=O)CCNS(=O)(=O)C1=CC(=C(C=C1)OC)OC

InChI

InChI=1S/C21H34N2O7S/c1-15(2)7-6-8-16(3)23-20(24)14-30-21(25)11-12-22-31(26,27)17-9-10-18(28-4)19(13-17)29-5/h9-10,13,15-16,22H,6-8,11-12,14H2,1-5H3,(H,23,24)