N-(4-methoxyphenyl)sulfonyl-N-[2-[(E)-2-(1-oxidanidylpyridin-1-ium-4-yl)ethenyl]phenyl]-2-piperidin-1-yl-ethanamide

Systemtic Name: N-(4-methoxyphenyl)sulfonyl-N-[2-[(E)-2-(1-oxidanidylpyridin-1-ium-4-yl)ethenyl]phenyl]-2-piperidin-1-yl-ethanamide Openeye Name: N-(4-methoxyphenyl)sulfonyl-N-[2-[(E)-2-(1-oxidopyridin-1-ium-4-yl)vinyl]phenyl]-2-(1-piperidyl)acetamide CAS Name: N-(4-methoxyphenyl)sulfonyl-N-[2-[(E)-2-(1-oxido-4-pyridin-1-iumyl)ethenyl]phenyl]-2-(1-piperidinyl)acetamide IUPAC Name: N-(4-methoxyphenyl)sulfonyl-N-[2-[(E)-2-(1-oxidopyridin-1-ium-4-yl)ethenyl]phenyl]-2-piperidin-1-ylacetamide Traditional Name: N-(4-methoxyphenyl)sulfonyl-N-[2-[(E)-2-(1-oxidopyridin-1-ium-4-yl)vinyl]phenyl]-2-piperidino-acetamide Formula: C27H29N3O5S MolecularWeight: 507.60126

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N(C2=CC=CC=C2C=CC3=CC=[N+](C=C3)[O-])C(=O)CN4CCCCC4

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N(C2=CC=CC=C2/C=C/C3=CC=[N+](C=C3)[O-])C(=O)CN4CCCCC4

InChI

InChI=1S/C27H29N3O5S/c1-35-24-11-13-25(14-12-24)36(33,34)30(27(31)21-28-17-5-2-6-18-28)26-8-4-3-7-23(26)10-9-22-15-19-29(32)20-16-22/h3-4,7-16,19-20H,2,5-6,17-18,21H2,1H3/b10-9+