4-[4-(1,3-benzodioxol-5-yl)piperazin-1-yl]sulfonylaniline

Systemtic Name: 4-[4-(1,3-benzodioxol-5-yl)piperazin-1-yl]sulfonylaniline Openeye Name: 4-[4-(1,3-benzodioxol-5-yl)piperazin-1-yl]sulfonylaniline CAS Name: 4-[[4-(1,3-benzodioxol-5-yl)-1-piperazinyl]sulfonyl]aniline IUPAC Name: 4-[4-(1,3-benzodioxol-5-yl)piperazin-1-yl]sulfonylaniline Traditional Name: [4-[4-(1,3-benzodioxol-5-yl)piperazino]sulfonylphenyl]amine Formula: C17H19N3O4S MolecularWeight: 361.41546

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC3=C(C=C2)OCO3)S(=O)(=O)C4=CC=C(C=C4)N

Isomeric SMILES

C1CN(CCN1C2=CC3=C(C=C2)OCO3)S(=O)(=O)C4=CC=C(C=C4)N

InChI

InChI=1S/C17H19N3O4S/c18-13-1-4-15(5-2-13)25(21,22)20-9-7-19(8-10-20)14-3-6-16-17(11-14)24-12-23-16/h1-6,11H,7-10,12,18H2