2-[isocyano-(4-methylphenyl)sulfonyl-methyl]-1,3-dimethoxy-benzene

Systemtic Name: 2-[isocyano-(4-methylphenyl)sulfonyl-methyl]-1,3-dimethoxy-benzene Openeye Name: 2-[isocyano(p-tolylsulfonyl)methyl]-1,3-dimethoxy-benzene CAS Name: 2-[isocyano-(4-methylphenyl)sulfonylmethyl]-1,3-dimethoxybenzene IUPAC Name: 2-[isocyano-(4-methylphenyl)sulfonylmethyl]-1,3-dimethoxybenzene Traditional Name: 2-[isocyano(tosyl)methyl]-1,3-dimethoxy-benzene Formula: C17H17NO4S MolecularWeight: 331.38618

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C(C2=C(C=CC=C2OC)OC)[N+]#[C-]

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C(C2=C(C=CC=C2OC)OC)[N+]#[C-]

InChI

InChI=1S/C17H17NO4S/c1-12-8-10-13(11-9-12)23(19,20)17(18-2)16-14(21-3)6-5-7-15(16)22-4/h5-11,17H,1,3-4H3