2-[(5-bromanylnaphthalen-1-yl)carbothioyl-(carboxymethyl)amino]ethanoic acid

Systemtic Name: 2-[(5-bromanylnaphthalen-1-yl)carbothioyl-(carboxymethyl)amino]ethanoic acid Openeye Name: 2-[(5-bromonaphthalene-1-carbothioyl)-(carboxymethyl)amino]acetic acid CAS Name: 2-[[(5-bromo-1-naphthalenyl)-sulfanylidenemethyl]-(carboxymethyl)amino]acetic acid IUPAC Name: 2-[(5-bromonaphthalene-1-carbothioyl)-(carboxymethyl)amino]acetic acid Traditional Name: 2-[(5-bromonaphthalene-1-carbothioyl)-(carboxymethyl)amino]acetic acid Formula: C15H12BrNO4S MolecularWeight: 382.22908

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CC=C2Br)C(=C1)C(=S)N(CC(=O)O)CC(=O)O

Isomeric SMILES

C1=CC2=C(C=CC=C2Br)C(=C1)C(=S)N(CC(=O)O)CC(=O)O

InChI

InChI=1S/C15H12BrNO4S/c16-12-6-2-3-9-10(12)4-1-5-11(9)15(22)17(7-13(18)19)8-14(20)21/h1-6H,7-8H2,(H,18,19)(H,20,21)