ethyl 2-[1-(2,4-dinitrophenyl)sulfanylpyrrolidin-2-yl]ethanoate

Systemtic Name: ethyl 2-[1-(2,4-dinitrophenyl)sulfanylpyrrolidin-2-yl]ethanoate Openeye Name: ethyl 2-[1-(2,4-dinitrophenyl)sulfanylpyrrolidin-2-yl]acetate CAS Name: 2-[1-[(2,4-dinitrophenyl)thio]-2-pyrrolidinyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[1-(2,4-dinitrophenyl)sulfanylpyrrolidin-2-yl]acetate Traditional Name: 2-[1-[(2,4-dinitrophenyl)thio]pyrrolidin-2-yl]acetic acid ethyl ester Formula: C14H17N3O6S MolecularWeight: 355.36628

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1CCCN1SC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)CC1CCCN1SC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C14H17N3O6S/c1-2-23-14(18)9-10-4-3-7-15(10)24-13-6-5-11(16(19)20)8-12(13)17(21)22/h5-6,8,10H,2-4,7,9H2,1H3