1-chloranyl-3-[isocyano-(4-methylphenyl)sulfonyl-methyl]benzene

Systemtic Name: 1-chloranyl-3-[isocyano-(4-methylphenyl)sulfonyl-methyl]benzene Openeye Name: 1-chloro-3-[isocyano(p-tolylsulfonyl)methyl]benzene CAS Name: 1-chloro-3-[isocyano-(4-methylphenyl)sulfonylmethyl]benzene IUPAC Name: 1-chloro-3-[isocyano-(4-methylphenyl)sulfonylmethyl]benzene Traditional Name: 1-chloro-3-[isocyano(tosyl)methyl]benzene Formula: C15H12ClNO2S MolecularWeight: 305.77928

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H12ClNO2S/c1-11-6-8-14(9-7-11)20(18,19)15(17-2)12-4-3-5-13(16)10-12/h3-10,15H,1H3