[4-(1,3-benzodioxol-5-ylmethylideneamino)phenyl] 4-butylbenzenesulfonate

Systemtic Name: [4-(1,3-benzodioxol-5-ylmethylideneamino)phenyl] 4-butylbenzenesulfonate Openeye Name: [4-(1,3-benzodioxol-5-ylmethyleneamino)phenyl] 4-butylbenzenesulfonate CAS Name: 4-butylbenzenesulfonic acid [4-(1,3-benzodioxol-5-ylmethylideneamino)phenyl] ester IUPAC Name: [4-(1,3-benzodioxol-5-ylmethylideneamino)phenyl] 4-butylbenzenesulfonate Traditional Name: 4-butylbenzenesulfonic acid [4-(piperonylideneamino)phenyl] ester Formula: C24H23NO5S MolecularWeight: 437.50812

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)S(=O)(=O)OC2=CC=C(C=C2)N=CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CCCCC1=CC=C(C=C1)S(=O)(=O)OC2=CC=C(C=C2)N=CC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C24H23NO5S/c1-2-3-4-18-5-12-22(13-6-18)31(26,27)30-21-10-8-20(9-11-21)25-16-19-7-14-23-24(15-19)29-17-28-23/h5-16H,2-4,17H2,1H3