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

Systemtic Name: (3R,4R)-N-(3-methoxyphenyl)-4-oxidanyl-3-[(4-phenylmethoxyphenyl)carbonylamino]azepane-1-carboxamide Openeye Name: (3R,4R)-3-[(4-benzyloxybenzoyl)amino]-4-hydroxy-N-(3-methoxyphenyl)azepane-1-carboxamide CAS Name: (3R,4R)-4-hydroxy-N-(3-methoxyphenyl)-3-[[oxo-(4-phenylmethoxyphenyl)methyl]amino]-1-azepanecarboxamide IUPAC Name: (3R,4R)-4-hydroxy-N-(3-methoxyphenyl)-3-[(4-phenylmethoxybenzoyl)amino]azepane-1-carboxamide Traditional Name: (3R,4R)-3-[(4-benzoxybenzoyl)amino]-4-hydroxy-N-(3-methoxyphenyl)azepane-1-carboxamide Formula: C28H31N3O5 MolecularWeight: 489.56284

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC(=O)N2CCCC(C(C2)NC(=O)C3=CC=C(C=C3)OCC4=CC=CC=C4)O

Isomeric SMILES

COC1=CC=CC(=C1)NC(=O)N2CCC[C@H]([C@@H](C2)NC(=O)C3=CC=C(C=C3)OCC4=CC=CC=C4)O

InChI

InChI=1S/C28H31N3O5/c1-35-24-10-5-9-22(17-24)29-28(34)31-16-6-11-26(32)25(18-31)30-27(33)21-12-14-23(15-13-21)36-19-20-7-3-2-4-8-20/h2-5,7-10,12-15,17,25-26,32H,6,11,16,18-19H2,1H3,(H,29,34)(H,30,33)/t25-,26-/m1/s1