3-[(1,3-benzodioxol-5-ylcarbonylamino)carbamoyl]-4-bromanyl-N-prop-2-enyl-benzenesulfonamide

Systemtic Name: 3-[(1,3-benzodioxol-5-ylcarbonylamino)carbamoyl]-4-bromanyl-N-prop-2-enyl-benzenesulfonamide Openeye Name: N-allyl-3-[(1,3-benzodioxole-5-carbonylamino)carbamoyl]-4-bromo-benzenesulfonamide CAS Name: 3-[[[1,3-benzodioxol-5-yl(oxo)methyl]hydrazo]-oxomethyl]-4-bromo-N-prop-2-enylbenzenesulfonamide IUPAC Name: 3-[(1,3-benzodioxole-5-carbonylamino)carbamoyl]-4-bromo-N-prop-2-enylbenzenesulfonamide Traditional Name: N-allyl-4-bromo-3-[(piperonyloylamino)carbamoyl]benzenesulfonamide Formula: C18H16BrN3O6S MolecularWeight: 482.30514

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNS(=O)(=O)C1=CC(=C(C=C1)Br)C(=O)NNC(=O)C2=CC3=C(C=C2)OCO3

Isomeric SMILES

C=CCNS(=O)(=O)C1=CC(=C(C=C1)Br)C(=O)NNC(=O)C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C18H16BrN3O6S/c1-2-7-20-29(25,26)12-4-5-14(19)13(9-12)18(24)22-21-17(23)11-3-6-15-16(8-11)28-10-27-15/h2-6,8-9,20H,1,7,10H2,(H,21,23)(H,22,24)