[2-(ethylcarbamoylamino)-2-oxidanylidene-ethyl] (3S)-1-(5-chloranyl-2-methoxy-phenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate

Systemtic Name: [2-(ethylcarbamoylamino)-2-oxidanylidene-ethyl] (3S)-1-(5-chloranyl-2-methoxy-phenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate Openeye Name: [2-(ethylcarbamoylamino)-2-oxo-ethyl] (3S)-1-(5-chloro-2-methoxy-phenyl)-5-oxo-pyrrolidine-3-carboxylate CAS Name: (3S)-1-(5-chloro-2-methoxyphenyl)-5-oxo-3-pyrrolidinecarboxylic acid [2-(ethylcarbamoylamino)-2-oxoethyl] ester IUPAC Name: [2-(ethylcarbamoylamino)-2-oxoethyl] (3S)-1-(5-chloro-2-methoxyphenyl)-5-oxopyrrolidine-3-carboxylate Traditional Name: (3S)-1-(5-chloro-2-methoxy-phenyl)-5-keto-pyrrolidine-3-carboxylic acid [2-(ethylcarbamoylamino)-2-keto-ethyl] ester Formula: C17H20ClN3O6 MolecularWeight: 397.8102

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)NC(=O)COC(=O)C1CC(=O)N(C1)C2=C(C=CC(=C2)Cl)OC

Isomeric SMILES

CCNC(=O)NC(=O)COC(=O)[C@H]1CC(=O)N(C1)C2=C(C=CC(=C2)Cl)OC

InChI

InChI=1S/C17H20ClN3O6/c1-3-19-17(25)20-14(22)9-27-16(24)10-6-15(23)21(8-10)12-7-11(18)4-5-13(12)26-2/h4-5,7,10H,3,6,8-9H2,1-2H3,(H2,19,20,22,25)/t10-/m0/s1