2-[2-[2-[6-(4-dimethylaminophenyl)quinolin-2-yl]oxyethoxy]ethoxy]ethyl 4-methylbenzenesulfonate

Systemtic Name: 2-[2-[2-[6-(4-dimethylaminophenyl)quinolin-2-yl]oxyethoxy]ethoxy]ethyl 4-methylbenzenesulfonate Openeye Name: 2-[2-[2-[[6-(4-dimethylaminophenyl)-2-quinolyl]oxy]ethoxy]ethoxy]ethyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid 2-[2-[2-[[6-(4-dimethylaminophenyl)-2-quinolinyl]oxy]ethoxy]ethoxy]ethyl ester IUPAC Name: 2-[2-[2-[6-(4-dimethylaminophenyl)quinolin-2-yl]oxyethoxy]ethoxy]ethyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid 2-[2-[2-[[6-(4-dimethylaminophenyl)-2-quinolyl]oxy]ethoxy]ethoxy]ethyl ester Formula: C30H34N2O6S MolecularWeight: 550.66576

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCCOCCOCCOC2=NC3=C(C=C2)C=C(C=C3)C4=CC=C(C=C4)N(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCCOCCOCCOC2=NC3=C(C=C2)C=C(C=C3)C4=CC=C(C=C4)N(C)C

InChI

InChI=1S/C30H34N2O6S/c1-23-4-12-28(13-5-23)39(33,34)38-21-19-36-17-16-35-18-20-37-30-15-9-26-22-25(8-14-29(26)31-30)24-6-10-27(11-7-24)32(2)3/h4-15,22H,16-21H2,1-3H3