cyclohexyl 3-[(4-but-2-ynoxyphenyl)sulfonylamino]-4-(oxidanylamino)-4-oxidanylidene-butanoate

Systemtic Name: cyclohexyl 3-[(4-but-2-ynoxyphenyl)sulfonylamino]-4-(oxidanylamino)-4-oxidanylidene-butanoate Openeye Name: cyclohexyl 3-[(4-but-2-ynoxyphenyl)sulfonylamino]-4-(hydroxyamino)-4-oxo-butanoate CAS Name: 3-[(4-but-2-ynoxyphenyl)sulfonylamino]-4-(hydroxyamino)-4-oxobutanoic acid cyclohexyl ester IUPAC Name: cyclohexyl 3-[(4-but-2-ynoxyphenyl)sulfonylamino]-4-(hydroxyamino)-4-oxobutanoate Traditional Name: 3-[(4-but-2-ynoxyphenyl)sulfonylamino]-4-(hydroxyamino)-4-keto-butyric acid cyclohexyl ester Formula: C20H26N2O7S MolecularWeight: 438.49464

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Descriptors Computed from Structure

Canonical SMILES:

CC#CCOC1=CC=C(C=C1)S(=O)(=O)NC(CC(=O)OC2CCCCC2)C(=O)NO

Isomeric SMILES

CC#CCOC1=CC=C(C=C1)S(=O)(=O)NC(CC(=O)OC2CCCCC2)C(=O)NO

InChI

InChI=1S/C20H26N2O7S/c1-2-3-13-28-15-9-11-17(12-10-15)30(26,27)22-18(20(24)21-25)14-19(23)29-16-7-5-4-6-8-16/h9-12,16,18,22,25H,4-8,13-14H2,1H3,(H,21,24)