4-[cyclopropyl-(2-ethoxy-2-oxidanylidene-ethyl)amino]-3-[(3-methylquinolin-8-yl)sulfonylamino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[cyclopropyl-(2-ethoxy-2-oxidanylidene-ethyl)amino]-3-[(3-methylquinolin-8-yl)sulfonylamino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[cyclopropyl-(2-ethoxy-2-oxo-ethyl)amino]-3-[(3-methyl-8-quinolyl)sulfonylamino]-4-oxo-butanoic acid CAS Name: 4-[cyclopropyl-(2-ethoxy-2-oxoethyl)amino]-3-[(3-methyl-8-quinolinyl)sulfonylamino]-4-oxobutanoic acid IUPAC Name: 4-[cyclopropyl-(2-ethoxy-2-oxoethyl)amino]-3-[(3-methylquinolin-8-yl)sulfonylamino]-4-oxobutanoic acid Traditional Name: 4-[cyclopropyl-(2-ethoxy-2-keto-ethyl)amino]-4-keto-3-[(3-methyl-8-quinolyl)sulfonylamino]butyric acid Formula: C21H25N3O7S MolecularWeight: 463.5041

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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=CC3=CC(=CN=C32)C

Isomeric SMILES

CCOC(=O)CN(C1CC1)C(=O)C(CC(=O)O)NS(=O)(=O)C2=CC=CC3=CC(=CN=C32)C

InChI

InChI=1S/C21H25N3O7S/c1-3-31-19(27)12-24(15-7-8-15)21(28)16(10-18(25)26)23-32(29,30)17-6-4-5-14-9-13(2)11-22-20(14)17/h4-6,9,11,15-16,23H,3,7-8,10,12H2,1-2H3,(H,25,26)