[(4-azanyl-3-oxidanyl-1-phenyl-butan-2-yl)-(4-azanyl-2-oxidanyl-4-phenyl-butyl)carbamoyl] 2-(2-hydroxyethyl)-3,3-dimethyl-butanoate

Systemtic Name: [(4-azanyl-3-oxidanyl-1-phenyl-butan-2-yl)-(4-azanyl-2-oxidanyl-4-phenyl-butyl)carbamoyl] 2-(2-hydroxyethyl)-3,3-dimethyl-butanoate Openeye Name: [(3-amino-1-benzyl-2-hydroxy-propyl)-(4-amino-2-hydroxy-4-phenyl-butyl)carbamoyl] 2-(2-hydroxyethyl)-3,3-dimethyl-butanoate CAS Name: 2-(2-hydroxyethyl)-3,3-dimethylbutanoic acid [[(4-amino-3-hydroxy-1-phenylbutan-2-yl)-(4-amino-2-hydroxy-4-phenylbutyl)amino]-oxomethyl] ester IUPAC Name: [(4-amino-3-hydroxy-1-phenylbutan-2-yl)-(4-amino-2-hydroxy-4-phenylbutyl)carbamoyl] 2-(2-hydroxyethyl)-3,3-dimethylbutanoate Traditional Name: 2-(2-hydroxyethyl)-3,3-dimethyl-butyric acid [(3-amino-1-benzyl-2-hydroxy-propyl)-(4-amino-2-hydroxy-4-phenyl-butyl)carbamoyl] ester Formula: C29H43N3O6 MolecularWeight: 529.66822

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(CCO)C(=O)OC(=O)N(CC(CC(C1=CC=CC=C1)N)O)C(CC2=CC=CC=C2)C(CN)O

Isomeric SMILES

CC(C)(C)C(CCO)C(=O)OC(=O)N(CC(CC(C1=CC=CC=C1)N)O)C(CC2=CC=CC=C2)C(CN)O

InChI

InChI=1S/C29H43N3O6/c1-29(2,3)23(14-15-33)27(36)38-28(37)32(19-22(34)17-24(31)21-12-8-5-9-13-21)25(26(35)18-30)16-20-10-6-4-7-11-20/h4-13,22-26,33-35H,14-19,30-31H2,1-3H3