(phenylmethyl) (2S)-2-[[(3R)-1-(1-methoxycarbonylcyclopropyl)-2-oxidanylidene-pyrrolidin-3-yl]carbamoyl]pyrrolidine-1-carboxylate

Systemtic Name: (phenylmethyl) (2S)-2-[[(3R)-1-(1-methoxycarbonylcyclopropyl)-2-oxidanylidene-pyrrolidin-3-yl]carbamoyl]pyrrolidine-1-carboxylate Openeye Name: benzyl (2S)-2-[[(3R)-1-(1-methoxycarbonylcyclopropyl)-2-oxo-pyrrolidin-3-yl]carbamoyl]pyrrolidine-1-carboxylate CAS Name: (2S)-2-[[[(3R)-1-(1-methoxycarbonylcyclopropyl)-2-oxo-3-pyrrolidinyl]amino]-oxomethyl]-1-pyrrolidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl (2S)-2-[[(3R)-1-(1-methoxycarbonylcyclopropyl)-2-oxopyrrolidin-3-yl]carbamoyl]pyrrolidine-1-carboxylate Traditional Name: (2S)-2-[[(3R)-1-(1-carbomethoxycyclopropyl)-2-keto-pyrrolidin-3-yl]carbamoyl]pyrrolidine-1-carboxylic acid benzyl ester Formula: C22H27N3O6 MolecularWeight: 429.46628

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1(CC1)N2CCC(C2=O)NC(=O)C3CCCN3C(=O)OCC4=CC=CC=C4

Isomeric SMILES

COC(=O)C1(CC1)N2CC[C@H](C2=O)NC(=O)[C@@H]3CCCN3C(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C22H27N3O6/c1-30-20(28)22(10-11-22)25-13-9-16(19(25)27)23-18(26)17-8-5-12-24(17)21(29)31-14-15-6-3-2-4-7-15/h2-4,6-7,16-17H,5,8-14H2,1H3,(H,23,26)/t16-,17+/m1/s1