1,2-bis(chloranyl)benzene; [5-[(4-methoxyphenyl)-methyl-amino]-5-oxidanylidene-pentyl] methanesulfonate

Systemtic Name: 1,2-bis(chloranyl)benzene; [5-[(4-methoxyphenyl)-methyl-amino]-5-oxidanylidene-pentyl] methanesulfonate Openeye Name: 1,2-dichlorobenzene; [5-(4-methoxy-N-methyl-anilino)-5-oxo-pentyl] methanesulfonate CAS Name: 1,2-dichlorobenzene; methanesulfonic acid [5-(4-methoxy-N-methylanilino)-5-oxopentyl] ester IUPAC Name: 1,2-dichlorobenzene; [5-(4-methoxy-N-methylanilino)-5-oxopentyl] methanesulfonate Traditional Name: 1,2-dichlorobenzene; methanesulfonic acid [5-keto-5-(4-methoxy-N-methyl-anilino)pentyl] ester Formula: C20H25Cl2NO5S MolecularWeight: 462.3872

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=C(C=C1)OC)C(=O)CCCCOS(=O)(=O)C.C1=CC=C(C(=C1)Cl)Cl

Isomeric SMILES

CN(C1=CC=C(C=C1)OC)C(=O)CCCCOS(=O)(=O)C.C1=CC=C(C(=C1)Cl)Cl

InChI

InChI=1S/C14H21NO5S.C6H4Cl2/c1-15(12-7-9-13(19-2)10-8-12)14(16)6-4-5-11-20-21(3,17)18;7-5-3-1-2-4-6(5)8/h7-10H,4-6,11H2,1-3H3;1-4H