[1-ethylsulfonyl-1-[2-[(E)-2-phenylethenyl]phenyl]-2H-pyridin-1-ium-5-yl]methanamine

Systemtic Name: [1-ethylsulfonyl-1-[2-[(E)-2-phenylethenyl]phenyl]-2H-pyridin-1-ium-5-yl]methanamine Openeye Name: [1-ethylsulfonyl-1-[2-[(E)-styryl]phenyl]-2H-pyridin-1-ium-5-yl]methanamine CAS Name: [1-ethylsulfonyl-1-[2-[(E)-2-phenylethenyl]phenyl]-2H-pyridin-1-ium-5-yl]methanamine IUPAC Name: [1-ethylsulfonyl-1-[2-[(E)-2-phenylethenyl]phenyl]-2H-pyridin-1-ium-5-yl]methanamine Traditional Name: [1-esyl-1-[2-[(E)-styryl]phenyl]-2H-pyridin-1-ium-5-yl]methylamine Formula: C22H25N2O2S+ MolecularWeight: 381.5111

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)[N+]1(CC=CC(=C1)CN)C2=CC=CC=C2C=CC3=CC=CC=C3

Isomeric SMILES

CCS(=O)(=O)[N+]1(CC=CC(=C1)CN)C2=CC=CC=C2/C=C/C3=CC=CC=C3

InChI

InChI=1S/C22H25N2O2S/c1-2-27(25,26)24(16-8-11-20(17-23)18-24)22-13-7-6-12-21(22)15-14-19-9-4-3-5-10-19/h3-15,18H,2,16-17,23H2,1H3/q+1/b15-14+