methyl (Z)-7-[(5R)-2-oxidanylidene-5-[(phenylmethyl)carbamoyloxymethyl]pyrrolidin-1-yl]hept-5-enoate

Systemtic Name: methyl (Z)-7-[(5R)-2-oxidanylidene-5-[(phenylmethyl)carbamoyloxymethyl]pyrrolidin-1-yl]hept-5-enoate Openeye Name: methyl (Z)-7-[(2R)-2-(benzylcarbamoyloxymethyl)-5-oxo-pyrrolidin-1-yl]hept-5-enoate CAS Name: (Z)-7-[(5R)-2-oxo-5-[[oxo-[(phenylmethyl)amino]methoxy]methyl]-1-pyrrolidinyl]-5-heptenoic acid methyl ester IUPAC Name: methyl (Z)-7-[(2R)-2-(benzylcarbamoyloxymethyl)-5-oxopyrrolidin-1-yl]hept-5-enoate Traditional Name: (Z)-7-[(2R)-2-(benzylcarbamoyloxymethyl)-5-keto-pyrrolidino]hept-5-enoic acid methyl ester Formula: C21H28N2O5 MolecularWeight: 388.45742

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCC=CCN1C(CCC1=O)COC(=O)NCC2=CC=CC=C2

Isomeric SMILES

COC(=O)CCC/C=C\CN1[C@H](CCC1=O)COC(=O)NCC2=CC=CC=C2

InChI

InChI=1S/C21H28N2O5/c1-27-20(25)11-7-2-3-8-14-23-18(12-13-19(23)24)16-28-21(26)22-15-17-9-5-4-6-10-17/h3-6,8-10,18H,2,7,11-16H2,1H3,(H,22,26)/b8-3-/t18-/m1/s1