[(2R)-1-(cyclopentylcarbamoylamino)-1-oxidanylidene-propan-2-yl] (2S,3S)-2-benzamido-3-methyl-pentanoate

Systemtic Name: [(2R)-1-(cyclopentylcarbamoylamino)-1-oxidanylidene-propan-2-yl] (2S,3S)-2-benzamido-3-methyl-pentanoate Openeye Name: [(1R)-2-(cyclopentylcarbamoylamino)-1-methyl-2-oxo-ethyl] (2S,3S)-2-benzamido-3-methyl-pentanoate CAS Name: (2S,3S)-2-benzamido-3-methylpentanoic acid [(2R)-1-[[(cyclopentylamino)-oxomethyl]amino]-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(cyclopentylcarbamoylamino)-1-oxopropan-2-yl] (2S,3S)-2-benzamido-3-methylpentanoate Traditional Name: (2S,3S)-2-benzamido-3-methyl-valeric acid [(1R)-2-(cyclopentylcarbamoylamino)-2-keto-1-methyl-ethyl] ester Formula: C22H31N3O5 MolecularWeight: 417.49864

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)OC(C)C(=O)NC(=O)NC1CCCC1)NC(=O)C2=CC=CC=C2

Isomeric SMILES

CC[C@H](C)[C@@H](C(=O)O[C@H](C)C(=O)NC(=O)NC1CCCC1)NC(=O)C2=CC=CC=C2

InChI

InChI=1S/C22H31N3O5/c1-4-14(2)18(24-20(27)16-10-6-5-7-11-16)21(28)30-15(3)19(26)25-22(29)23-17-12-8-9-13-17/h5-7,10-11,14-15,17-18H,4,8-9,12-13H2,1-3H3,(H,24,27)(H2,23,25,26,29)/t14-,15+,18-/m0/s1