2-[(2R,3S)-3-[[(2R)-2-azanyl-3-phenylmethoxy-propanoyl]amino]-2-oxidanyl-4-phenyl-butyl]-N-tert-butyl-benzamide

Systemtic Name: 2-[(2R,3S)-3-[[(2R)-2-azanyl-3-phenylmethoxy-propanoyl]amino]-2-oxidanyl-4-phenyl-butyl]-N-tert-butyl-benzamide Openeye Name: 2-[(2R,3S)-3-[[(2R)-2-amino-3-benzyloxy-propanoyl]amino]-2-hydroxy-4-phenyl-butyl]-N-tert-butyl-benzamide CAS Name: 2-[(2R,3S)-3-[[(2R)-2-amino-1-oxo-3-phenylmethoxypropyl]amino]-2-hydroxy-4-phenylbutyl]-N-tert-butylbenzamide IUPAC Name: 2-[(2R,3S)-3-[[(2R)-2-amino-3-phenylmethoxypropanoyl]amino]-2-hydroxy-4-phenylbutyl]-N-tert-butylbenzamide Traditional Name: 2-[(2R,3S)-3-[[(2R)-2-amino-3-benzoxy-propanoyl]amino]-2-hydroxy-4-phenyl-butyl]-N-tert-butyl-benzamide Formula: C31H39N3O4 MolecularWeight: 517.65906

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)C1=CC=CC=C1CC(C(CC2=CC=CC=C2)NC(=O)C(COCC3=CC=CC=C3)N)O

Isomeric SMILES

CC(C)(C)NC(=O)C1=CC=CC=C1C[C@H]([C@H](CC2=CC=CC=C2)NC(=O)[C@@H](COCC3=CC=CC=C3)N)O

InChI

InChI=1S/C31H39N3O4/c1-31(2,3)34-29(36)25-17-11-10-16-24(25)19-28(35)27(18-22-12-6-4-7-13-22)33-30(37)26(32)21-38-20-23-14-8-5-9-15-23/h4-17,26-28,35H,18-21,32H2,1-3H3,(H,33,37)(H,34,36)/t26-,27+,28-/m1/s1