(3R,4R)-4-oxidanyl-N-phenyl-3-[(4-phenylmethoxyphenyl)carbonylamino]azepane-1-carboxamide

Systemtic Name: (3R,4R)-4-oxidanyl-N-phenyl-3-[(4-phenylmethoxyphenyl)carbonylamino]azepane-1-carboxamide Openeye Name: (3R,4R)-3-[(4-benzyloxybenzoyl)amino]-4-hydroxy-N-phenyl-azepane-1-carboxamide CAS Name: (3R,4R)-4-hydroxy-3-[[oxo-(4-phenylmethoxyphenyl)methyl]amino]-N-phenyl-1-azepanecarboxamide IUPAC Name: (3R,4R)-4-hydroxy-N-phenyl-3-[(4-phenylmethoxybenzoyl)amino]azepane-1-carboxamide Traditional Name: (3R,4R)-3-[(4-benzoxybenzoyl)amino]-4-hydroxy-N-phenyl-azepane-1-carboxamide Formula: C27H29N3O4 MolecularWeight: 459.53686

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C(CN(C1)C(=O)NC2=CC=CC=C2)NC(=O)C3=CC=C(C=C3)OCC4=CC=CC=C4)O

Isomeric SMILES

C1C[C@H]([C@@H](CN(C1)C(=O)NC2=CC=CC=C2)NC(=O)C3=CC=C(C=C3)OCC4=CC=CC=C4)O

InChI

InChI=1S/C27H29N3O4/c31-25-12-7-17-30(27(33)28-22-10-5-2-6-11-22)18-24(25)29-26(32)21-13-15-23(16-14-21)34-19-20-8-3-1-4-9-20/h1-6,8-11,13-16,24-25,31H,7,12,17-19H2,(H,28,33)(H,29,32)/t24-,25-/m1/s1