methyl (2S,4R,5S)-4-(3-phenylpropyl)-1-prop-2-enoyl-5-prop-2-enyl-pyrrolidine-2-carboxylate

Systemtic Name: methyl (2S,4R,5S)-4-(3-phenylpropyl)-1-prop-2-enoyl-5-prop-2-enyl-pyrrolidine-2-carboxylate Openeye Name: methyl (2S,4R,5S)-5-allyl-4-(3-phenylpropyl)-1-prop-2-enoyl-pyrrolidine-2-carboxylate CAS Name: (2S,4R,5S)-1-(1-oxoprop-2-enyl)-4-(3-phenylpropyl)-5-prop-2-enyl-2-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl (2S,4R,5S)-4-(3-phenylpropyl)-1-prop-2-enoyl-5-prop-2-enylpyrrolidine-2-carboxylate Traditional Name: (2S,4R,5S)-1-acryloyl-5-allyl-4-(3-phenylpropyl)pyrrolidine-2-carboxylic acid methyl ester Formula: C21H27NO3 MolecularWeight: 341.44398

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CC(C(N1C(=O)C=C)CC=C)CCCC2=CC=CC=C2

Isomeric SMILES

COC(=O)[C@@H]1C[C@H]([C@@H](N1C(=O)C=C)CC=C)CCCC2=CC=CC=C2

InChI

InChI=1S/C21H27NO3/c1-4-10-18-17(14-9-13-16-11-7-6-8-12-16)15-19(21(24)25-3)22(18)20(23)5-2/h4-8,11-12,17-19H,1-2,9-10,13-15H2,3H3/t17-,18+,19+/m1/s1