diethylazanium; [(4-methylphenyl)amino]-phenyl-methanesulfonate

Systemtic Name: diethylazanium; [(4-methylphenyl)amino]-phenyl-methanesulfonate Openeye Name: diethylammonium; (4-methylanilino)-phenyl-methanesulfonate CAS Name: diethylammonium; (4-methylanilino)-phenylmethanesulfonate IUPAC Name: diethylazanium; (4-methylanilino)-phenylmethanesulfonate Traditional Name: diethylammonium; phenyl(p-toluidino)methanesulfonate Formula: C18H26N2O3S MolecularWeight: 350.47564

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH2+]CC.CC1=CC=C(C=C1)NC(C2=CC=CC=C2)S(=O)(=O)[O-]

Isomeric SMILES

CC[NH2+]CC.CC1=CC=C(C=C1)NC(C2=CC=CC=C2)S(=O)(=O)[O-]

InChI

InChI=1S/C14H15NO3S.C4H11N/c1-11-7-9-13(10-8-11)15-14(19(16,17)18)12-5-3-2-4-6-12;1-3-5-4-2/h2-10,14-15H,1H3,(H,16,17,18);5H,3-4H2,1-2H3