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

Systemtic Name: (4-azanyl-1-phenyl-butan-2-yl)-[4-[(2,2-dimethyl-4-oxidanyl-butanoyl)amino]-4-phenyl-butyl]carbamic acid Openeye Name: (3-amino-1-benzyl-propyl)-[4-[(4-hydroxy-2,2-dimethyl-butanoyl)amino]-4-phenyl-butyl]carbamic acid CAS Name: (4-amino-1-phenylbutan-2-yl)-[4-[(4-hydroxy-2,2-dimethyl-1-oxobutyl)amino]-4-phenylbutyl]carbamic acid IUPAC Name: (4-amino-1-phenylbutan-2-yl)-[4-[(4-hydroxy-2,2-dimethylbutanoyl)amino]-4-phenylbutyl]carbamic acid Traditional Name: (3-amino-1-benzyl-propyl)-[4-[(4-hydroxy-2,2-dimethyl-butanoyl)amino]-4-phenyl-butyl]carbamic acid Formula: C27H39N3O4 MolecularWeight: 469.61626

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCO)C(=O)NC(CCCN(C(CCN)CC1=CC=CC=C1)C(=O)O)C2=CC=CC=C2

Isomeric SMILES

CC(C)(CCO)C(=O)NC(CCCN(C(CCN)CC1=CC=CC=C1)C(=O)O)C2=CC=CC=C2

InChI

InChI=1S/C27H39N3O4/c1-27(2,16-19-31)25(32)29-24(22-12-7-4-8-13-22)14-9-18-30(26(33)34)23(15-17-28)20-21-10-5-3-6-11-21/h3-8,10-13,23-24,31H,9,14-20,28H2,1-2H3,(H,29,32)(H,33,34)