methyl 5-(dimethylamino)-2-[2-oxidanylidene-3-(phenylmethoxycarbonylamino)pyrrolidin-1-yl]cyclohexane-1-carboxylate

Systemtic Name: methyl 5-(dimethylamino)-2-[2-oxidanylidene-3-(phenylmethoxycarbonylamino)pyrrolidin-1-yl]cyclohexane-1-carboxylate Openeye Name: methyl 2-[3-(benzyloxycarbonylamino)-2-oxo-pyrrolidin-1-yl]-5-(dimethylamino)cyclohexanecarboxylate CAS Name: 5-(dimethylamino)-2-[2-oxo-3-(phenylmethoxycarbonylamino)-1-pyrrolidinyl]-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl 5-(dimethylamino)-2-[2-oxo-3-(phenylmethoxycarbonylamino)pyrrolidin-1-yl]cyclohexane-1-carboxylate Traditional Name: 2-[3-(benzyloxycarbonylamino)-2-keto-pyrrolidino]-5-(dimethylamino)cyclohexanecarboxylic acid methyl ester Formula: C22H31N3O5 MolecularWeight: 417.49864

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1CCC(C(C1)C(=O)OC)N2CCC(C2=O)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

CN(C)C1CCC(C(C1)C(=O)OC)N2CCC(C2=O)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C22H31N3O5/c1-24(2)16-9-10-19(17(13-16)21(27)29-3)25-12-11-18(20(25)26)23-22(28)30-14-15-7-5-4-6-8-15/h4-8,16-19H,9-14H2,1-3H3,(H,23,28)