methyl (2R,3S,5S,6S)-4-methyl-6-(methylamino)-7-oxidanylidene-2,5-diphenyl-1,4-oxazepane-3-carboxylate

Systemtic Name: methyl (2R,3S,5S,6S)-4-methyl-6-(methylamino)-7-oxidanylidene-2,5-diphenyl-1,4-oxazepane-3-carboxylate Openeye Name: methyl (2R,3S,5S,6S)-4-methyl-6-(methylamino)-7-oxo-2,5-diphenyl-1,4-oxazepane-3-carboxylate CAS Name: (2R,3S,5S,6S)-4-methyl-6-(methylamino)-7-oxo-2,5-diphenyl-1,4-oxazepane-3-carboxylic acid methyl ester IUPAC Name: methyl (2R,3S,5S,6S)-4-methyl-6-(methylamino)-7-oxo-2,5-diphenyl-1,4-oxazepane-3-carboxylate Traditional Name: (2R,3S,5S,6S)-7-keto-4-methyl-6-(methylamino)-2,5-diphenyl-1,4-oxazepane-3-carboxylic acid methyl ester Formula: C21H24N2O4 MolecularWeight: 368.42626

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Descriptors Computed from Structure

Canonical SMILES:

CNC1C(N(C(C(OC1=O)C2=CC=CC=C2)C(=O)OC)C)C3=CC=CC=C3

Isomeric SMILES

CN[C@H]1[C@@H](N([C@@H]([C@H](OC1=O)C2=CC=CC=C2)C(=O)OC)C)C3=CC=CC=C3

InChI

InChI=1S/C21H24N2O4/c1-22-16-17(14-10-6-4-7-11-14)23(2)18(21(25)26-3)19(27-20(16)24)15-12-8-5-9-13-15/h4-13,16-19,22H,1-3H3/t16-,17-,18-,19+/m0/s1