(4-cyano-2,2-dimethyl-butyl)-[3-(1,3-dioxan-5-yloxycarbonylamino)-2-oxidanyl-4-phenyl-butyl]carbamic acid

Systemtic Name: (4-cyano-2,2-dimethyl-butyl)-[3-(1,3-dioxan-5-yloxycarbonylamino)-2-oxidanyl-4-phenyl-butyl]carbamic acid Openeye Name: (4-cyano-2,2-dimethyl-butyl)-[3-(1,3-dioxan-5-yloxycarbonylamino)-2-hydroxy-4-phenyl-butyl]carbamic acid CAS Name: (4-cyano-2,2-dimethylbutyl)-[3-[[1,3-dioxan-5-yloxy(oxo)methyl]amino]-2-hydroxy-4-phenylbutyl]carbamic acid IUPAC Name: (4-cyano-2,2-dimethylbutyl)-[3-(1,3-dioxan-5-yloxycarbonylamino)-2-hydroxy-4-phenylbutyl]carbamic acid Traditional Name: (4-cyano-2,2-dimethyl-butyl)-[3-(1,3-dioxan-5-yloxycarbonylamino)-2-hydroxy-4-phenyl-butyl]carbamic acid Formula: C23H33N3O7 MolecularWeight: 463.52402

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCC#N)CN(CC(C(CC1=CC=CC=C1)NC(=O)OC2COCOC2)O)C(=O)O

Isomeric SMILES

CC(C)(CCC#N)CN(CC(C(CC1=CC=CC=C1)NC(=O)OC2COCOC2)O)C(=O)O

InChI

InChI=1S/C23H33N3O7/c1-23(2,9-6-10-24)15-26(22(29)30)12-20(27)19(11-17-7-4-3-5-8-17)25-21(28)33-18-13-31-16-32-14-18/h3-5,7-8,18-20,27H,6,9,11-16H2,1-2H3,(H,25,28)(H,29,30)