1-methyl-4-[5-(4-methylphenyl)sulfonyloxy-3-(sulfinoamino)pentoxy]sulfonyl-benzene

Systemtic Name: 1-methyl-4-[5-(4-methylphenyl)sulfonyloxy-3-(sulfinoamino)pentoxy]sulfonyl-benzene Openeye Name: 1-methyl-4-[5-(p-tolylsulfonyloxy)-3-(sulfinoamino)pentoxy]sulfonyl-benzene CAS Name: 1-methyl-4-[5-(4-methylphenyl)sulfonyloxy-3-(sulfinoamino)pentoxy]sulfonylbenzene IUPAC Name: 1-methyl-4-[5-(4-methylphenyl)sulfonyloxy-3-(sulfinoamino)pentoxy]sulfonylbenzene Traditional Name: 1-methyl-4-[3-(sulfinoamino)-5-tosyloxy-pentoxy]sulfonyl-benzene Formula: C19H25NO8S3 MolecularWeight: 491.5987

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCCC(CCOS(=O)(=O)C2=CC=C(C=C2)C)NS(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCCC(CCOS(=O)(=O)C2=CC=C(C=C2)C)NS(=O)O

InChI

InChI=1S/C19H25NO8S3/c1-15-3-7-18(8-4-15)30(23,24)27-13-11-17(20-29(21)22)12-14-28-31(25,26)19-9-5-16(2)6-10-19/h3-10,17,20H,11-14H2,1-2H3,(H,21,22)