3-[(4-bromophenyl)sulfonylamino]-N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]propanamide

Systemtic Name: 3-[(4-bromophenyl)sulfonylamino]-N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]propanamide Openeye Name: 3-[(4-bromophenyl)sulfonylamino]-N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]propanamide CAS Name: 3-[(4-bromophenyl)sulfonylamino]-N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]propanamide IUPAC Name: 3-[(4-bromophenyl)sulfonylamino]-N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]propanamide Traditional Name: 3-(brosylamino)-N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]propionamide Formula: C18H19BrN2O5S MolecularWeight: 455.32286

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC2=CC=CC=C2O1)CNC(=O)CCNS(=O)(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

C1[C@@H](OC2=CC=CC=C2O1)CNC(=O)CCNS(=O)(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C18H19BrN2O5S/c19-13-5-7-15(8-6-13)27(23,24)21-10-9-18(22)20-11-14-12-25-16-3-1-2-4-17(16)26-14/h1-8,14,21H,9-12H2,(H,20,22)/t14-/m0/s1