azane; 5-bromanyl-3-[1-(5-bromanyl-3-carboxy-2-methoxy-phenyl)undec-1-enyl]-2-methoxy-benzoic acid

Systemtic Name: azane; 5-bromanyl-3-[1-(5-bromanyl-3-carboxy-2-methoxy-phenyl)undec-1-enyl]-2-methoxy-benzoic acid Openeye Name: ammonia; 5-bromo-3-[1-(5-bromo-3-carboxy-2-methoxy-phenyl)undec-1-enyl]-2-methoxy-benzoic acid CAS Name: ammonia; 5-bromo-3-[1-(5-bromo-3-carboxy-2-methoxyphenyl)undec-1-enyl]-2-methoxybenzoic acid IUPAC Name: azane; 5-bromo-3-[1-(5-bromo-3-carboxy-2-methoxyphenyl)undec-1-enyl]-2-methoxybenzoic acid Traditional Name: ammonia; 5-bromo-3-[1-(5-bromo-3-carboxy-2-methoxy-phenyl)undec-1-enyl]-2-methoxy-benzoic acid Formula: C27H35Br2NO6 MolecularWeight: 629.3779

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC=C(C1=CC(=CC(=C1OC)C(=O)O)Br)C2=CC(=CC(=C2OC)C(=O)O)Br.N

Isomeric SMILES

CCCCCCCCCC=C(C1=CC(=CC(=C1OC)C(=O)O)Br)C2=CC(=CC(=C2OC)C(=O)O)Br.N

InChI

InChI=1S/C27H32Br2O6.H3N/c1-4-5-6-7-8-9-10-11-12-19(20-13-17(28)15-22(26(30)31)24(20)34-2)21-14-18(29)16-23(27(32)33)25(21)35-3;/h12-16H,4-11H2,1-3H3,(H,30,31)(H,32,33);1H3