1-[1-isocyano-2-(4-methoxyphenyl)ethyl]sulfonyl-4-methyl-benzene

Systemtic Name: 1-[1-isocyano-2-(4-methoxyphenyl)ethyl]sulfonyl-4-methyl-benzene Openeye Name: 1-[1-isocyano-2-(4-methoxyphenyl)ethyl]sulfonyl-4-methyl-benzene CAS Name: 1-[1-isocyano-2-(4-methoxyphenyl)ethyl]sulfonyl-4-methylbenzene IUPAC Name: 1-[1-isocyano-2-(4-methoxyphenyl)ethyl]sulfonyl-4-methylbenzene Traditional Name: 1-[1-isocyano-2-(4-methoxyphenyl)ethyl]sulfonyl-4-methyl-benzene Formula: C17H17NO3S MolecularWeight: 315.38678

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C(CC2=CC=C(C=C2)OC)[N+]#[C-]

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C(CC2=CC=C(C=C2)OC)[N+]#[C-]

InChI

InChI=1S/C17H17NO3S/c1-13-4-10-16(11-5-13)22(19,20)17(18-2)12-14-6-8-15(21-3)9-7-14/h4-11,17H,12H2,1,3H3