2-diethylaminoethyl 2-methyl-3-(4-methylphenyl)sulfonyloxy-2-phenyl-propanoate chloride

Systemtic Name: 2-diethylaminoethyl 2-methyl-3-(4-methylphenyl)sulfonyloxy-2-phenyl-propanoate chloride Openeye Name: 2-diethylaminoethyl 2-methyl-2-phenyl-3-(p-tolylsulfonyloxy)propanoate chloride CAS Name: 2-methyl-3-(4-methylphenyl)sulfonyloxy-2-phenylpropanoic acid 2-diethylaminoethyl ester chloride IUPAC Name: 2-diethylaminoethyl 2-methyl-3-(4-methylphenyl)sulfonyloxy-2-phenylpropanoate chloride Traditional Name: 2-methyl-2-phenyl-3-tosyloxy-propionic acid 2-diethylaminoethyl ester chloride Formula: C23H31ClNO5S- MolecularWeight: 469.01394

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCOC(=O)C(C)(COS(=O)(=O)C1=CC=C(C=C1)C)C2=CC=CC=C2.[Cl-]

Isomeric SMILES

CCN(CC)CCOC(=O)C(C)(COS(=O)(=O)C1=CC=C(C=C1)C)C2=CC=CC=C2.[Cl-]

InChI

InChI=1S/C23H31NO5S.ClH/c1-5-24(6-2)16-17-28-22(25)23(4,20-10-8-7-9-11-20)18-29-30(26,27)21-14-12-19(3)13-15-21;/h7-15H,5-6,16-18H2,1-4H3;1H/p-1