methyl 2-oxidanylidene-1-[phenyl(phenylmethoxycarbonylamino)methyl]cycloheptane-1-carboxylate

Systemtic Name: methyl 2-oxidanylidene-1-[phenyl(phenylmethoxycarbonylamino)methyl]cycloheptane-1-carboxylate Openeye Name: methyl 1-[benzyloxycarbonylamino(phenyl)methyl]-2-oxo-cycloheptanecarboxylate CAS Name: 2-oxo-1-[phenyl(phenylmethoxycarbonylamino)methyl]-1-cycloheptanecarboxylic acid methyl ester IUPAC Name: methyl 2-oxo-1-[phenyl(phenylmethoxycarbonylamino)methyl]cycloheptane-1-carboxylate Traditional Name: 1-[benzyloxycarbonylamino(phenyl)methyl]-2-keto-cycloheptanecarboxylic acid methyl ester Formula: C24H27NO5 MolecularWeight: 409.47488

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1(CCCCCC1=O)C(C2=CC=CC=C2)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

COC(=O)C1(CCCCCC1=O)C(C2=CC=CC=C2)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C24H27NO5/c1-29-22(27)24(16-10-4-9-15-20(24)26)21(19-13-7-3-8-14-19)25-23(28)30-17-18-11-5-2-6-12-18/h2-3,5-8,11-14,21H,4,9-10,15-17H2,1H3,(H,25,28)