3-[(4-tert-butylphenyl)sulfonylamino]-4-[cyclopropyl-(2-ethoxy-2-oxidanylidene-ethyl)amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 3-[(4-tert-butylphenyl)sulfonylamino]-4-[cyclopropyl-(2-ethoxy-2-oxidanylidene-ethyl)amino]-4-oxidanylidene-butanoic acid Openeye Name: 3-[(4-tert-butylphenyl)sulfonylamino]-4-[cyclopropyl-(2-ethoxy-2-oxo-ethyl)amino]-4-oxo-butanoic acid CAS Name: 3-[(4-tert-butylphenyl)sulfonylamino]-4-[cyclopropyl-(2-ethoxy-2-oxoethyl)amino]-4-oxobutanoic acid IUPAC Name: 3-[(4-tert-butylphenyl)sulfonylamino]-4-[cyclopropyl-(2-ethoxy-2-oxoethyl)amino]-4-oxobutanoic acid Traditional Name: 3-[(4-tert-butylphenyl)sulfonylamino]-4-[cyclopropyl-(2-ethoxy-2-keto-ethyl)amino]-4-keto-butyric acid Formula: C21H30N2O7S MolecularWeight: 454.5371

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN(C1CC1)C(=O)C(CC(=O)O)NS(=O)(=O)C2=CC=C(C=C2)C(C)(C)C

Isomeric SMILES

CCOC(=O)CN(C1CC1)C(=O)C(CC(=O)O)NS(=O)(=O)C2=CC=C(C=C2)C(C)(C)C

InChI

InChI=1S/C21H30N2O7S/c1-5-30-19(26)13-23(15-8-9-15)20(27)17(12-18(24)25)22-31(28,29)16-10-6-14(7-11-16)21(2,3)4/h6-7,10-11,15,17,22H,5,8-9,12-13H2,1-4H3,(H,24,25)