(4-azanyl-3-oxidanyl-1-phenyl-butan-2-yl)-[4-[(3,3-dimethyl-2-oxidanylidene-butanoyl)amino]-2-oxidanyl-4-phenyl-butyl]carbamic acid

Systemtic Name: (4-azanyl-3-oxidanyl-1-phenyl-butan-2-yl)-[4-[(3,3-dimethyl-2-oxidanylidene-butanoyl)amino]-2-oxidanyl-4-phenyl-butyl]carbamic acid Openeye Name: (3-amino-1-benzyl-2-hydroxy-propyl)-[4-[(3,3-dimethyl-2-oxo-butanoyl)amino]-2-hydroxy-4-phenyl-butyl]carbamic acid CAS Name: (4-amino-3-hydroxy-1-phenylbutan-2-yl)-[4-[(3,3-dimethyl-1,2-dioxobutyl)amino]-2-hydroxy-4-phenylbutyl]carbamic acid IUPAC Name: (4-amino-3-hydroxy-1-phenylbutan-2-yl)-[4-[(3,3-dimethyl-2-oxobutanoyl)amino]-2-hydroxy-4-phenylbutyl]carbamic acid Traditional Name: (3-amino-1-benzyl-2-hydroxy-propyl)-[2-hydroxy-4-[(2-keto-3,3-dimethyl-butanoyl)amino]-4-phenyl-butyl]carbamic acid Formula: C27H37N3O6 MolecularWeight: 499.59918

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)C(=O)NC(CC(CN(C(CC1=CC=CC=C1)C(CN)O)C(=O)O)O)C2=CC=CC=C2

Isomeric SMILES

CC(C)(C)C(=O)C(=O)NC(CC(CN(C(CC1=CC=CC=C1)C(CN)O)C(=O)O)O)C2=CC=CC=C2

InChI

InChI=1S/C27H37N3O6/c1-27(2,3)24(33)25(34)29-21(19-12-8-5-9-13-19)15-20(31)17-30(26(35)36)22(23(32)16-28)14-18-10-6-4-7-11-18/h4-13,20-23,31-32H,14-17,28H2,1-3H3,(H,29,34)(H,35,36)