7-[1-isocyano-1-(4-methylphenyl)sulfonyl-ethyl]-4a-methyl-2,3,4,5-tetrahydro-1H-naphthalene

Systemtic Name: 7-[1-isocyano-1-(4-methylphenyl)sulfonyl-ethyl]-4a-methyl-2,3,4,5-tetrahydro-1H-naphthalene Openeye Name: 7-[1-isocyano-1-(p-tolylsulfonyl)ethyl]-4a-methyl-2,3,4,5-tetrahydro-1H-naphthalene CAS Name: 7-[1-isocyano-1-(4-methylphenyl)sulfonylethyl]-4a-methyl-2,3,4,5-tetrahydro-1H-naphthalene IUPAC Name: 7-[1-isocyano-1-(4-methylphenyl)sulfonylethyl]-4a-methyl-2,3,4,5-tetrahydro-1H-naphthalene Traditional Name: 7-(1-isocyano-1-tosyl-ethyl)-4a-methyl-2,3,4,5-tetrahydro-1H-naphthalene Formula: C21H25NO2S MolecularWeight: 355.4937

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C(C)(C2=CCC3(CCCCC3=C2)C)[N+]#[C-]

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C(C)(C2=CCC3(CCCCC3=C2)C)[N+]#[C-]

InChI

InChI=1S/C21H25NO2S/c1-16-8-10-19(11-9-16)25(23,24)21(3,22-4)18-12-14-20(2)13-6-5-7-17(20)15-18/h8-12,15H,5-7,13-14H2,1-3H3