methyl (1S,2S)-2-(2-methoxy-2-oxidanylidene-ethyl)-1-(phenylmethoxycarbonylamino)cyclopropane-1-carboxylate

Systemtic Name: methyl (1S,2S)-2-(2-methoxy-2-oxidanylidene-ethyl)-1-(phenylmethoxycarbonylamino)cyclopropane-1-carboxylate Openeye Name: methyl (1S,2S)-1-(benzyloxycarbonylamino)-2-(2-methoxy-2-oxo-ethyl)cyclopropanecarboxylate CAS Name: (1S,2S)-2-(2-methoxy-2-oxoethyl)-1-(phenylmethoxycarbonylamino)-1-cyclopropanecarboxylic acid methyl ester IUPAC Name: methyl (1S,2S)-2-(2-methoxy-2-oxoethyl)-1-(phenylmethoxycarbonylamino)cyclopropane-1-carboxylate Traditional Name: (1S,2S)-1-(benzyloxycarbonylamino)-2-(2-keto-2-methoxy-ethyl)cyclopropanecarboxylic acid methyl ester Formula: C16H19NO6 MolecularWeight: 321.32516

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1CC1(C(=O)OC)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

COC(=O)C[C@@H]1C[C@]1(C(=O)OC)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C16H19NO6/c1-21-13(18)8-12-9-16(12,14(19)22-2)17-15(20)23-10-11-6-4-3-5-7-11/h3-7,12H,8-10H2,1-2H3,(H,17,20)/t12-,16+/m1/s1