cyclopentanesulfonate; N,N-dimethyl-4-[(E)-2-(1-methylpyridin-1-ium-2-yl)ethenyl]aniline

Systemtic Name: cyclopentanesulfonate; N,N-dimethyl-4-[(E)-2-(1-methylpyridin-1-ium-2-yl)ethenyl]aniline Openeye Name: cyclopentanesulfonate; N,N-dimethyl-4-[(E)-2-(1-methylpyridin-1-ium-2-yl)vinyl]aniline CAS Name: cyclopentanesulfonate; N,N-dimethyl-4-[(E)-2-(1-methyl-2-pyridin-1-iumyl)ethenyl]aniline IUPAC Name: cyclopentanesulfonate; N,N-dimethyl-4-[(E)-2-(1-methylpyridin-1-ium-2-yl)ethenyl]aniline Traditional Name: cyclopentanesulfonate; dimethyl-[4-[(E)-2-(1-methylpyridin-1-ium-2-yl)vinyl]phenyl]amine Formula: C21H28N2O3S MolecularWeight: 388.52362

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CC=CC=C1C=CC2=CC=C(C=C2)N(C)C.C1CCC(C1)S(=O)(=O)[O-]

Isomeric SMILES

C[N+]1=CC=CC=C1/C=C/C2=CC=C(C=C2)N(C)C.C1CCC(C1)S(=O)(=O)[O-]

InChI

InChI=1S/C16H19N2.C5H10O3S/c1-17(2)15-10-7-14(8-11-15)9-12-16-6-4-5-13-18(16)3;6-9(7,8)5-3-1-2-4-5/h4-13H,1-3H3;5H,1-4H2,(H,6,7,8)/q+1;/p-1