2-[tert-butyl(quinolin-2-ylcarbonyl)amino]-N-(2-oxidanyl-4-phenyl-butyl)butanediamide

Systemtic Name: 2-[tert-butyl(quinolin-2-ylcarbonyl)amino]-N-(2-oxidanyl-4-phenyl-butyl)butanediamide Openeye Name: 2-[tert-butyl(quinoline-2-carbonyl)amino]-N-(2-hydroxy-4-phenyl-butyl)butanediamide CAS Name: 2-[tert-butyl-[oxo(2-quinolinyl)methyl]amino]-N-(2-hydroxy-4-phenylbutyl)butanediamide IUPAC Name: 2-[tert-butyl(quinoline-2-carbonyl)amino]-N-(2-hydroxy-4-phenylbutyl)butanediamide Traditional Name: 2-[tert-butyl(quinaldoyl)amino]-N-(2-hydroxy-4-phenyl-butyl)succinamide Formula: C28H34N4O4 MolecularWeight: 490.59396

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N(C(CC(=O)N)C(=O)NCC(CCC1=CC=CC=C1)O)C(=O)C2=NC3=CC=CC=C3C=C2

Isomeric SMILES

CC(C)(C)N(C(CC(=O)N)C(=O)NCC(CCC1=CC=CC=C1)O)C(=O)C2=NC3=CC=CC=C3C=C2

InChI

InChI=1S/C28H34N4O4/c1-28(2,3)32(27(36)23-16-14-20-11-7-8-12-22(20)31-23)24(17-25(29)34)26(35)30-18-21(33)15-13-19-9-5-4-6-10-19/h4-12,14,16,21,24,33H,13,15,17-18H2,1-3H3,(H2,29,34)(H,30,35)