4-[2-(4-methyl-3-nitro-phenyl)sulfonylethyl]pyridine hydrochloride

Systemtic Name: 4-[2-(4-methyl-3-nitro-phenyl)sulfonylethyl]pyridine hydrochloride Openeye Name: 4-[2-(4-methyl-3-nitro-phenyl)sulfonylethyl]pyridine hydrochloride CAS Name: 4-[2-(4-methyl-3-nitrophenyl)sulfonylethyl]pyridine hydrochloride IUPAC Name: 4-[2-(4-methyl-3-nitrophenyl)sulfonylethyl]pyridine hydrochloride Traditional Name: 4-[2-(4-methyl-3-nitro-phenyl)sulfonylethyl]pyridine hydrochloride Formula: C14H15ClN2O4S MolecularWeight: 342.7979

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)CCC2=CC=NC=C2)[N+](=O)[O-].Cl

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)CCC2=CC=NC=C2)[N+](=O)[O-].Cl

InChI

InChI=1S/C14H14N2O4S.ClH/c1-11-2-3-13(10-14(11)16(17)18)21(19,20)9-6-12-4-7-15-8-5-12;/h2-5,7-8,10H,6,9H2,1H3;1H