[2-(4-nitrophenyl)-2-oxidanylidene-ethyl] N-prop-2-enylpyrrolidine-1-carboximidothioate

Systemtic Name: [2-(4-nitrophenyl)-2-oxidanylidene-ethyl] N-prop-2-enylpyrrolidine-1-carboximidothioate Openeye Name: [2-(4-nitrophenyl)-2-oxo-ethyl] N-allylpyrrolidine-1-carboximidothioate CAS Name: N-prop-2-enyl-1-pyrrolidinecarboximidothioic acid [2-(4-nitrophenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-nitrophenyl)-2-oxoethyl] N-prop-2-enylpyrrolidine-1-carboximidothioate Traditional Name: N-allylpyrrolidine-1-carboximidothioic acid [2-keto-2-(4-nitrophenyl)ethyl] ester Formula: C16H19N3O3S MolecularWeight: 333.40536

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN=C(N1CCCC1)SCC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C=CCN=C(N1CCCC1)SCC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H19N3O3S/c1-2-9-17-16(18-10-3-4-11-18)23-12-15(20)13-5-7-14(8-6-13)19(21)22/h2,5-8H,1,3-4,9-12H2