5-[4-(4-dimethylaminophenyl)phenyl]sulfonylpentyl butanoate

Systemtic Name: 5-[4-(4-dimethylaminophenyl)phenyl]sulfonylpentyl butanoate Openeye Name: 5-[4-(4-dimethylaminophenyl)phenyl]sulfonylpentyl butanoate CAS Name: butanoic acid 5-[4-(4-dimethylaminophenyl)phenyl]sulfonylpentyl ester IUPAC Name: 5-[4-(4-dimethylaminophenyl)phenyl]sulfonylpentyl butanoate Traditional Name: butyric acid 5-[4-(4-dimethylaminophenyl)phenyl]sulfonylpentyl ester Formula: C23H31NO4S MolecularWeight: 417.56154

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)OCCCCCS(=O)(=O)C1=CC=C(C=C1)C2=CC=C(C=C2)N(C)C

Isomeric SMILES

CCCC(=O)OCCCCCS(=O)(=O)C1=CC=C(C=C1)C2=CC=C(C=C2)N(C)C

InChI

InChI=1S/C23H31NO4S/c1-4-8-23(25)28-17-6-5-7-18-29(26,27)22-15-11-20(12-16-22)19-9-13-21(14-10-19)24(2)3/h9-16H,4-8,17-18H2,1-3H3