methyl 4-ethenyl-1-[(2-nitrophenyl)methyl]-2-sulfanylidene-pyrrolidine-3-carboxylate

Systemtic Name: methyl 4-ethenyl-1-[(2-nitrophenyl)methyl]-2-sulfanylidene-pyrrolidine-3-carboxylate Openeye Name: methyl 1-[(2-nitrophenyl)methyl]-2-thioxo-4-vinyl-pyrrolidine-3-carboxylate CAS Name: 4-ethenyl-1-[(2-nitrophenyl)methyl]-2-sulfanylidene-3-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl 4-ethenyl-1-[(2-nitrophenyl)methyl]-2-sulfanylidenepyrrolidine-3-carboxylate Traditional Name: 1-(2-nitrobenzyl)-2-thioxo-4-vinyl-pyrrolidine-3-carboxylic acid methyl ester Formula: C15H16N2O4S MolecularWeight: 320.36354

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1C(CN(C1=S)CC2=CC=CC=C2[N+](=O)[O-])C=C

Isomeric SMILES

COC(=O)C1C(CN(C1=S)CC2=CC=CC=C2[N+](=O)[O-])C=C

InChI

InChI=1S/C15H16N2O4S/c1-3-10-8-16(14(22)13(10)15(18)21-2)9-11-6-4-5-7-12(11)17(19)20/h3-7,10,13H,1,8-9H2,2H3