[4-(butoxycarbonylamino)-2-oxidanyl-4-phenyl-butyl]-(4-cyano-2,2-dimethyl-butyl)carbamic acid

Systemtic Name: [4-(butoxycarbonylamino)-2-oxidanyl-4-phenyl-butyl]-(4-cyano-2,2-dimethyl-butyl)carbamic acid Openeye Name: [4-(butoxycarbonylamino)-2-hydroxy-4-phenyl-butyl]-(4-cyano-2,2-dimethyl-butyl)carbamic acid CAS Name: [4-[[butoxy(oxo)methyl]amino]-2-hydroxy-4-phenylbutyl]-(4-cyano-2,2-dimethylbutyl)carbamic acid IUPAC Name: [4-(butoxycarbonylamino)-2-hydroxy-4-phenylbutyl]-(4-cyano-2,2-dimethylbutyl)carbamic acid Traditional Name: [4-(butoxycarbonylamino)-2-hydroxy-4-phenyl-butyl]-(4-cyano-2,2-dimethyl-butyl)carbamic acid Formula: C23H35N3O5 MolecularWeight: 433.5411

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)NC(CC(CN(CC(C)(C)CCC#N)C(=O)O)O)C1=CC=CC=C1

Isomeric SMILES

CCCCOC(=O)NC(CC(CN(CC(C)(C)CCC#N)C(=O)O)O)C1=CC=CC=C1

InChI

InChI=1S/C23H35N3O5/c1-4-5-14-31-21(28)25-20(18-10-7-6-8-11-18)15-19(27)16-26(22(29)30)17-23(2,3)12-9-13-24/h6-8,10-11,19-20,27H,4-5,9,12,14-17H2,1-3H3,(H,25,28)(H,29,30)