5-chloranyl-2-[7-(4-methylsulfonylphenyl)spiro[4.4]non-7-en-8-yl]pyridine

Systemtic Name: 5-chloranyl-2-[7-(4-methylsulfonylphenyl)spiro[4.4]non-7-en-8-yl]pyridine Openeye Name: 5-chloro-2-[7-(4-methylsulfonylphenyl)spiro[4.4]non-7-en-8-yl]pyridine CAS Name: 5-chloro-2-[7-(4-methylsulfonylphenyl)-8-spiro[4.4]non-7-enyl]pyridine IUPAC Name: 5-chloro-2-[7-(4-methylsulfonylphenyl)spiro[4.4]non-7-en-8-yl]pyridine Traditional Name: 5-chloro-2-[7-(4-mesylphenyl)spiro[4.4]non-7-en-8-yl]pyridine Formula: C21H22ClNO2S MolecularWeight: 387.92288

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C2=C(CC3(C2)CCCC3)C4=NC=C(C=C4)Cl

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C2=C(CC3(C2)CCCC3)C4=NC=C(C=C4)Cl

InChI

InChI=1S/C21H22ClNO2S/c1-26(24,25)17-7-4-15(5-8-17)18-12-21(10-2-3-11-21)13-19(18)20-9-6-16(22)14-23-20/h4-9,14H,2-3,10-13H2,1H3