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

Systemtic Name: 2,3,4,5-tetrakis(bromanyl)-6-[(4-butoxycarbonylphenyl)carbamoyl]benzoic acid Openeye Name: 2,3,4,5-tetrabromo-6-[(4-butoxycarbonylphenyl)carbamoyl]benzoic acid CAS Name: 2,3,4,5-tetrabromo-6-[[4-[butoxy(oxo)methyl]anilino]-oxomethyl]benzoic acid IUPAC Name: 2,3,4,5-tetrabromo-6-[(4-butoxycarbonylphenyl)carbamoyl]benzoic acid Traditional Name: 2,3,4,5-tetrabromo-6-[(4-butoxycarbonylphenyl)carbamoyl]benzoic acid Formula: C19H15Br4NO5 MolecularWeight: 656.9421

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)C2=C(C(=C(C(=C2Br)Br)Br)Br)C(=O)O

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)C2=C(C(=C(C(=C2Br)Br)Br)Br)C(=O)O

InChI

InChI=1S/C19H15Br4NO5/c1-2-3-8-29-19(28)9-4-6-10(7-5-9)24-17(25)11-12(18(26)27)14(21)16(23)15(22)13(11)20/h4-7H,2-3,8H2,1H3,(H,24,25)(H,26,27)