[2-(3-methylbutylcarbamoylamino)-2-oxidanylidene-ethyl] (3S)-1-[(2-chlorophenyl)methyl]-5-oxidanylidene-pyrrolidine-3-carboxylate

Systemtic Name: [2-(3-methylbutylcarbamoylamino)-2-oxidanylidene-ethyl] (3S)-1-[(2-chlorophenyl)methyl]-5-oxidanylidene-pyrrolidine-3-carboxylate Openeye Name: [2-(isopentylcarbamoylamino)-2-oxo-ethyl] (3S)-1-[(2-chlorophenyl)methyl]-5-oxo-pyrrolidine-3-carboxylate CAS Name: (3S)-1-[(2-chlorophenyl)methyl]-5-oxo-3-pyrrolidinecarboxylic acid [2-[[(3-methylbutylamino)-oxomethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-(3-methylbutylcarbamoylamino)-2-oxoethyl] (3S)-1-[(2-chlorophenyl)methyl]-5-oxopyrrolidine-3-carboxylate Traditional Name: (3S)-1-(2-chlorobenzyl)-5-keto-pyrrolidine-3-carboxylic acid [2-(isoamylcarbamoylamino)-2-keto-ethyl] ester Formula: C20H26ClN3O5 MolecularWeight: 423.89054

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)NC(=O)COC(=O)C1CC(=O)N(C1)CC2=CC=CC=C2Cl

Isomeric SMILES

CC(C)CCNC(=O)NC(=O)COC(=O)[C@H]1CC(=O)N(C1)CC2=CC=CC=C2Cl

InChI

InChI=1S/C20H26ClN3O5/c1-13(2)7-8-22-20(28)23-17(25)12-29-19(27)15-9-18(26)24(11-15)10-14-5-3-4-6-16(14)21/h3-6,13,15H,7-12H2,1-2H3,(H2,22,23,25,28)/t15-/m0/s1