2-[(4-bromophenyl)sulfonylamino]-3-(1H-indol-3-yl)propanoic acid

Systemtic Name: 2-[(4-bromophenyl)sulfonylamino]-3-(1H-indol-3-yl)propanoic acid Openeye Name: 2-[(4-bromophenyl)sulfonylamino]-3-(1H-indol-3-yl)propanoic acid CAS Name: 2-[(4-bromophenyl)sulfonylamino]-3-(1H-indol-3-yl)propanoic acid IUPAC Name: 2-[(4-bromophenyl)sulfonylamino]-3-(1H-indol-3-yl)propanoic acid Traditional Name: 2-(brosylamino)-3-(1H-indol-3-yl)propionic acid Formula: C17H15BrN2O4S MolecularWeight: 423.281

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2)CC(C(=O)O)NS(=O)(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2)CC(C(=O)O)NS(=O)(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C17H15BrN2O4S/c18-12-5-7-13(8-6-12)25(23,24)20-16(17(21)22)9-11-10-19-15-4-2-1-3-14(11)15/h1-8,10,16,19-20H,9H2,(H,21,22)