ethyl 7-cyano-6-methyl-5-oxidanylidene-6-(phenylmethoxycarbonylamino)-2,3-dihydro-1H-pyrrolizine-3-carboxylate

Systemtic Name: ethyl 7-cyano-6-methyl-5-oxidanylidene-6-(phenylmethoxycarbonylamino)-2,3-dihydro-1H-pyrrolizine-3-carboxylate Openeye Name: ethyl 6-(benzyloxycarbonylamino)-7-cyano-6-methyl-5-oxo-2,3-dihydro-1H-pyrrolizine-3-carboxylate CAS Name: 7-cyano-6-methyl-5-oxo-6-(phenylmethoxycarbonylamino)-2,3-dihydro-1H-pyrrolizine-3-carboxylic acid ethyl ester IUPAC Name: ethyl 7-cyano-6-methyl-5-oxo-6-(phenylmethoxycarbonylamino)-2,3-dihydro-1H-pyrrolizine-3-carboxylate Traditional Name: 6-(benzyloxycarbonylamino)-7-cyano-5-keto-6-methyl-2,3-dihydro-1H-pyrrolizine-3-carboxylic acid ethyl ester Formula: C20H21N3O5 MolecularWeight: 383.39784

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCC2=C(C(C(=O)N12)(C)NC(=O)OCC3=CC=CC=C3)C#N

Isomeric SMILES

CCOC(=O)C1CCC2=C(C(C(=O)N12)(C)NC(=O)OCC3=CC=CC=C3)C#N

InChI

InChI=1S/C20H21N3O5/c1-3-27-17(24)16-10-9-15-14(11-21)20(2,18(25)23(15)16)22-19(26)28-12-13-7-5-4-6-8-13/h4-8,16H,3,9-10,12H2,1-2H3,(H,22,26)