5-[7-(4-chlorophenyl)spiro[4.4]nona-6,8-dien-8-yl]-2-methylsulfonyl-pyridine

Systemtic Name: 5-[7-(4-chlorophenyl)spiro[4.4]nona-6,8-dien-8-yl]-2-methylsulfonyl-pyridine Openeye Name: 5-[7-(4-chlorophenyl)spiro[4.4]nona-6,8-dien-8-yl]-2-methylsulfonyl-pyridine CAS Name: 5-[7-(4-chlorophenyl)-8-spiro[4.4]nona-6,8-dienyl]-2-methylsulfonylpyridine IUPAC Name: 5-[7-(4-chlorophenyl)spiro[4.4]nona-6,8-dien-8-yl]-2-methylsulfonylpyridine Traditional Name: 5-[7-(4-chlorophenyl)spiro[4.4]nona-6,8-dien-8-yl]-2-mesyl-pyridine Formula: C21H20ClNO2S MolecularWeight: 385.907

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=NC=C(C=C1)C2=CC3(CCCC3)C=C2C4=CC=C(C=C4)Cl

Isomeric SMILES

CS(=O)(=O)C1=NC=C(C=C1)C2=CC3(CCCC3)C=C2C4=CC=C(C=C4)Cl

InChI

InChI=1S/C21H20ClNO2S/c1-26(24,25)20-9-6-16(14-23-20)19-13-21(10-2-3-11-21)12-18(19)15-4-7-17(22)8-5-15/h4-9,12-14H,2-3,10-11H2,1H3