2-[3-(dimethylamino)-4-methoxy-phenyl]ethyl 4-methylbenzenesulfonate

Systemtic Name: 2-[3-(dimethylamino)-4-methoxy-phenyl]ethyl 4-methylbenzenesulfonate Openeye Name: 2-[3-(dimethylamino)-4-methoxy-phenyl]ethyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid 2-[3-(dimethylamino)-4-methoxyphenyl]ethyl ester IUPAC Name: 2-[3-(dimethylamino)-4-methoxyphenyl]ethyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid 2-[3-(dimethylamino)-4-methoxy-phenyl]ethyl ester Formula: C18H23NO4S MolecularWeight: 349.44452

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCCC2=CC(=C(C=C2)OC)N(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCCC2=CC(=C(C=C2)OC)N(C)C

InChI

InChI=1S/C18H23NO4S/c1-14-5-8-16(9-6-14)24(20,21)23-12-11-15-7-10-18(22-4)17(13-15)19(2)3/h5-10,13H,11-12H2,1-4H3