4-[8-(5-cyanopyridin-2-yl)spiro[4.4]nona-6,8-dien-7-yl]benzenesulfonamide

Systemtic Name: 4-[8-(5-cyanopyridin-2-yl)spiro[4.4]nona-6,8-dien-7-yl]benzenesulfonamide Openeye Name: 4-[8-(5-cyano-2-pyridyl)spiro[4.4]nona-6,8-dien-7-yl]benzenesulfonamide CAS Name: 4-[8-(5-cyano-2-pyridinyl)-7-spiro[4.4]nona-6,8-dienyl]benzenesulfonamide IUPAC Name: 4-[8-(5-cyanopyridin-2-yl)spiro[4.4]nona-6,8-dien-7-yl]benzenesulfonamide Traditional Name: 4-[8-(5-cyano-2-pyridyl)spiro[4.4]nona-6,8-dien-7-yl]benzenesulfonamide Formula: C21H19N3O2S MolecularWeight: 377.45946

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2(C1)C=C(C(=C2)C3=NC=C(C=C3)C#N)C4=CC=C(C=C4)S(=O)(=O)N

Isomeric SMILES

C1CCC2(C1)C=C(C(=C2)C3=NC=C(C=C3)C#N)C4=CC=C(C=C4)S(=O)(=O)N

InChI

InChI=1S/C21H19N3O2S/c22-13-15-3-8-20(24-14-15)19-12-21(9-1-2-10-21)11-18(19)16-4-6-17(7-5-16)27(23,25)26/h3-8,11-12,14H,1-2,9-10H2,(H2,23,25,26)