2,3,4,5-tetrakis(bromanyl)-6-[(5-oxidanylnaphthalen-1-yl)carbamoyl]benzoic acid

Systemtic Name: 2,3,4,5-tetrakis(bromanyl)-6-[(5-oxidanylnaphthalen-1-yl)carbamoyl]benzoic acid Openeye Name: 2,3,4,5-tetrabromo-6-[(5-hydroxy-1-naphthyl)carbamoyl]benzoic acid CAS Name: 2,3,4,5-tetrabromo-6-[[(5-hydroxy-1-naphthalenyl)amino]-oxomethyl]benzoic acid IUPAC Name: 2,3,4,5-tetrabromo-6-[(5-hydroxynaphthalen-1-yl)carbamoyl]benzoic acid Traditional Name: 2,3,4,5-tetrabromo-6-[(5-hydroxy-1-naphthyl)carbamoyl]benzoic acid Formula: C18H9Br4NO4 MolecularWeight: 622.88436

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CC=C2O)C(=C1)NC(=O)C3=C(C(=C(C(=C3Br)Br)Br)Br)C(=O)O

Isomeric SMILES

C1=CC2=C(C=CC=C2O)C(=C1)NC(=O)C3=C(C(=C(C(=C3Br)Br)Br)Br)C(=O)O

InChI

InChI=1S/C18H9Br4NO4/c19-13-11(12(18(26)27)14(20)16(22)15(13)21)17(25)23-9-5-1-4-8-7(9)3-2-6-10(8)24/h1-6,24H,(H,23,25)(H,26,27)