tert-butyl 4-[(4-but-2-ynoxyphenyl)carbonylamino]-2-(oxidanylamino)-4-(2-oxidanylideneethyl)piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[(4-but-2-ynoxyphenyl)carbonylamino]-2-(oxidanylamino)-4-(2-oxidanylideneethyl)piperidine-1-carboxylate Openeye Name: tert-butyl 4-[(4-but-2-ynoxybenzoyl)amino]-2-(hydroxyamino)-4-(2-oxoethyl)piperidine-1-carboxylate CAS Name: 4-[[(4-but-2-ynoxyphenyl)-oxomethyl]amino]-2-(hydroxyamino)-4-(2-oxoethyl)-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[(4-but-2-ynoxybenzoyl)amino]-2-(hydroxyamino)-4-(2-oxoethyl)piperidine-1-carboxylate Traditional Name: 4-[(4-but-2-ynoxybenzoyl)amino]-2-(hydroxyamino)-4-(2-ketoethyl)piperidine-1-carboxylic acid tert-butyl ester Formula: C23H31N3O6 MolecularWeight: 445.50874

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Descriptors Computed from Structure

Canonical SMILES:

CC#CCOC1=CC=C(C=C1)C(=O)NC2(CCN(C(C2)NO)C(=O)OC(C)(C)C)CC=O

Isomeric SMILES

CC#CCOC1=CC=C(C=C1)C(=O)NC2(CCN(C(C2)NO)C(=O)OC(C)(C)C)CC=O

InChI

InChI=1S/C23H31N3O6/c1-5-6-15-31-18-9-7-17(8-10-18)20(28)24-23(12-14-27)11-13-26(19(16-23)25-30)21(29)32-22(2,3)4/h7-10,14,19,25,30H,11-13,15-16H2,1-4H3,(H,24,28)