3-azanylidene-2-[4-(phenylsulfonylmethyl)pyridin-1-ium-1-yl]prop-2-enenitrile

Systemtic Name: 3-azanylidene-2-[4-(phenylsulfonylmethyl)pyridin-1-ium-1-yl]prop-2-enenitrile Openeye Name: 2-[4-(benzenesulfonylmethyl)pyridin-1-ium-1-yl]-3-imino-prop-2-enenitrile CAS Name: 2-[4-(benzenesulfonylmethyl)-1-pyridin-1-iumyl]-3-imino-2-propenenitrile IUPAC Name: 2-[4-(benzenesulfonylmethyl)pyridin-1-ium-1-yl]-3-iminoprop-2-enenitrile Traditional Name: 2-[4-(besylmethyl)pyridin-1-ium-1-yl]-3-imino-acrylonitrile Formula: C15H12N3O2S+ MolecularWeight: 298.33968

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)CC2=CC=[N+](C=C2)C(=C=N)C#N

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)CC2=CC=[N+](C=C2)C(=C=N)C#N

InChI

InChI=1S/C15H12N3O2S/c16-10-14(11-17)18-8-6-13(7-9-18)12-21(19,20)15-4-2-1-3-5-15/h1-9,16H,12H2/q+1