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(phenylmethyl) (2S)-1-[4-methyl-2-(2-methylprop-2-enyl)-2-nitro-pent-4-enoyl]pyrrolidine-2-carboxylate

(phenylmethyl) (2S)-1-[4-methyl-2-(2-methylprop-2-enyl)-2-nitro-pent-4-enoyl]pyrrolidine-2-carboxylate

Systemtic Name:(phenylmethyl) (2S)-1-[4-methyl-2-(2-methylprop-2-enyl)-2-nitro-pent-4-enoyl]pyrrolidine-2-carboxylate
Openeye Name:benzyl (2S)-1-[4-methyl-2-(2-methylallyl)-2-nitro-pent-4-enoyl]pyrrolidine-2-carboxylate
CAS Name:(2S)-1-[4-methyl-2-(2-methylprop-2-enyl)-2-nitro-1-oxopent-4-enyl]-2-pyrrolidinecarboxylic acid (phenylmethyl) ester
IUPAC Name:benzyl (2S)-1-[4-methyl-2-(2-methylprop-2-enyl)-2-nitropent-4-enoyl]pyrrolidine-2-carboxylate
Traditional Name:(2S)-1-[4-methyl-2-(2-methylallyl)-2-nitro-pent-4-enoyl]pyrrolidine-2-carboxylic acid benzyl ester
Formula: C22H28N2O5
MolecularWeight: 400.46812
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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)CC(CC(=C)C)(C(=O)N1CCCC1C(=O)OCC2=CC=CC=C2)[N+](=O)[O-]


Isomeric SMILES

CC(=C)CC(CC(=C)C)(C(=O)N1CCC[C@H]1C(=O)OCC2=CC=CC=C2)[N+](=O)[O-]


InChI

InChI=1S/C22H28N2O5/c1-16(2)13-22(24(27)28,14-17(3)4)21(26)23-12-8-11-19(23)20(25)29-15-18-9-6-5-7-10-18/h5-7,9-10,19H,1,3,8,11-15H2,2,4H3/t19-/m0/s1


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