N-[(E)-4-(1,3-benzodioxol-5-yl)butan-2-ylideneamino]benzenesulfonamide

Systemtic Name: N-[(E)-4-(1,3-benzodioxol-5-yl)butan-2-ylideneamino]benzenesulfonamide Openeye Name: N-[(E)-[3-(1,3-benzodioxol-5-yl)-1-methyl-propylidene]amino]benzenesulfonamide CAS Name: N-[(E)-4-(1,3-benzodioxol-5-yl)butan-2-ylideneamino]benzenesulfonamide IUPAC Name: N-[(E)-4-(1,3-benzodioxol-5-yl)butan-2-ylideneamino]benzenesulfonamide Traditional Name: N-[(E)-[3-(1,3-benzodioxol-5-yl)-1-methyl-propylidene]amino]benzenesulfonamide Formula: C17H18N2O4S MolecularWeight: 346.40082

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNS(=O)(=O)C1=CC=CC=C1)CCC2=CC3=C(C=C2)OCO3

Isomeric SMILES

C/C(=N\NS(=O)(=O)C1=CC=CC=C1)/CCC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C17H18N2O4S/c1-13(18-19-24(20,21)15-5-3-2-4-6-15)7-8-14-9-10-16-17(11-14)23-12-22-16/h2-6,9-11,19H,7-8,12H2,1H3/b18-13+