methyl (2S)-2-[(3R)-2-oxidanylidene-3-(phenylmethoxycarbonylamino)-3-prop-2-enyl-pyrrolidin-1-yl]pentanoate

Systemtic Name: methyl (2S)-2-[(3R)-2-oxidanylidene-3-(phenylmethoxycarbonylamino)-3-prop-2-enyl-pyrrolidin-1-yl]pentanoate Openeye Name: methyl (2S)-2-[(3R)-3-allyl-3-(benzyloxycarbonylamino)-2-oxo-pyrrolidin-1-yl]pentanoate CAS Name: (2S)-2-[(3R)-2-oxo-3-(phenylmethoxycarbonylamino)-3-prop-2-enyl-1-pyrrolidinyl]pentanoic acid methyl ester IUPAC Name: methyl (2S)-2-[(3R)-2-oxo-3-(phenylmethoxycarbonylamino)-3-prop-2-enylpyrrolidin-1-yl]pentanoate Traditional Name: (2S)-2-[(3R)-3-allyl-3-(benzyloxycarbonylamino)-2-keto-pyrrolidino]valeric acid methyl ester Formula: C21H28N2O5 MolecularWeight: 388.45742

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)OC)N1CCC(C1=O)(CC=C)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CCC[C@@H](C(=O)OC)N1CC[C@@](C1=O)(CC=C)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C21H28N2O5/c1-4-9-17(18(24)27-3)23-14-13-21(12-5-2,19(23)25)22-20(26)28-15-16-10-7-6-8-11-16/h5-8,10-11,17H,2,4,9,12-15H2,1,3H3,(H,22,26)/t17-,21+/m0/s1