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

Systemtic Name: methyl 5-(tert-butylamino)-2-[2-oxidanylidene-3-(phenylmethoxycarbonylamino)pyrrolidin-1-yl]cyclohexane-1-carboxylate Openeye Name: methyl 2-[3-(benzyloxycarbonylamino)-2-oxo-pyrrolidin-1-yl]-5-(tert-butylamino)cyclohexanecarboxylate CAS Name: 5-(tert-butylamino)-2-[2-oxo-3-(phenylmethoxycarbonylamino)-1-pyrrolidinyl]-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl 5-(tert-butylamino)-2-[2-oxo-3-(phenylmethoxycarbonylamino)pyrrolidin-1-yl]cyclohexane-1-carboxylate Traditional Name: 2-[3-(benzyloxycarbonylamino)-2-keto-pyrrolidino]-5-(tert-butylamino)cyclohexanecarboxylic acid methyl ester Formula: C24H35N3O5 MolecularWeight: 445.5518

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC1CCC(C(C1)C(=O)OC)N2CCC(C2=O)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)NC1CCC(C(C1)C(=O)OC)N2CCC(C2=O)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C24H35N3O5/c1-24(2,3)26-17-10-11-20(18(14-17)22(29)31-4)27-13-12-19(21(27)28)25-23(30)32-15-16-8-6-5-7-9-16/h5-9,17-20,26H,10-15H2,1-4H3,(H,25,30)