2-[(4-bromophenyl)sulfonyl-(2-oxidanylidene-2-phenylazanyl-ethyl)amino]ethanoic acid

Systemtic Name: 2-[(4-bromophenyl)sulfonyl-(2-oxidanylidene-2-phenylazanyl-ethyl)amino]ethanoic acid Openeye Name: 2-[(2-anilino-2-oxo-ethyl)-(4-bromophenyl)sulfonyl-amino]acetic acid CAS Name: 2-[(2-anilino-2-oxoethyl)-(4-bromophenyl)sulfonylamino]acetic acid IUPAC Name: 2-[(2-anilino-2-oxoethyl)-(4-bromophenyl)sulfonylamino]acetic acid Traditional Name: 2-[(2-anilino-2-keto-ethyl)-brosyl-amino]acetic acid Formula: C16H15BrN2O5S MolecularWeight: 427.2697

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)CN(CC(=O)O)S(=O)(=O)C2=CC=C(C=C2)Br

Isomeric SMILES

C1=CC=C(C=C1)NC(=O)CN(CC(=O)O)S(=O)(=O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C16H15BrN2O5S/c17-12-6-8-14(9-7-12)25(23,24)19(11-16(21)22)10-15(20)18-13-4-2-1-3-5-13/h1-9H,10-11H2,(H,18,20)(H,21,22)