(4-ethoxyphenyl)sulfonyl-[phenyl-(pyridin-1-ium-2-ylamino)methylidene]azanium

Systemtic Name: (4-ethoxyphenyl)sulfonyl-[phenyl-(pyridin-1-ium-2-ylamino)methylidene]azanium Openeye Name: (4-ethoxyphenyl)sulfonyl-[phenyl-(pyridin-1-ium-2-ylamino)methylene]ammonium CAS Name: (4-ethoxyphenyl)sulfonyl-[phenyl-(2-pyridin-1-iumylamino)methylidene]ammonium IUPAC Name: (4-ethoxyphenyl)sulfonyl-[phenyl-(pyridin-1-ium-2-ylamino)methylidene]azanium Traditional Name: [phenyl-(pyridin-1-ium-2-ylamino)methylene]-p-phenetylsulfonyl-ammonium Formula: C20H21N3O3S+2 MolecularWeight: 383.46404

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)S(=O)(=O)[NH+]=C(C2=CC=CC=C2)NC3=CC=CC=[NH+]3

Isomeric SMILES

CCOC1=CC=C(C=C1)S(=O)(=O)[NH+]=C(C2=CC=CC=C2)NC3=CC=CC=[NH+]3

InChI

InChI=1S/C20H19N3O3S/c1-2-26-17-11-13-18(14-12-17)27(24,25)23-20(16-8-4-3-5-9-16)22-19-10-6-7-15-21-19/h3-15H,2H2,1H3,(H,21,22,23)/p+2