2-carbonobromidoylbenzoic acid; guanidine

Systemtic Name: 2-carbonobromidoylbenzoic acid; guanidine Openeye Name: 2-bromocarbonylbenzoic acid; guanidine CAS Name: 2-carbonobromidoylbenzoic acid; guanidine IUPAC Name: 2-carbonobromidoylbenzoic acid; guanidine Traditional Name: 2-bromocarbonylbenzoic acid; guanidine Formula: C33H25Br4N3O12 MolecularWeight: 975.1805

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)O)C(=O)Br.C1=CC=C(C(=C1)C(=O)O)C(=O)Br.C1=CC=C(C(=C1)C(=O)O)C(=O)Br.C1=CC=C(C(=C1)C(=O)O)C(=O)Br.C(=N)(N)N

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)O)C(=O)Br.C1=CC=C(C(=C1)C(=O)O)C(=O)Br.C1=CC=C(C(=C1)C(=O)O)C(=O)Br.C1=CC=C(C(=C1)C(=O)O)C(=O)Br.C(=N)(N)N

InChI

InChI=1S/4C8H5BrO3.CH5N3/c4*9-7(10)5-3-1-2-4-6(5)8(11)12;2-1(3)4/h4*1-4H,(H,11,12);(H5,2,3,4)