azane; 5-[1-(3-carboxy-5-chloranyl-4-methoxy-phenyl)undec-1-enyl]-3-chloranyl-2-methoxy-benzoic acid

Systemtic Name: azane; 5-[1-(3-carboxy-5-chloranyl-4-methoxy-phenyl)undec-1-enyl]-3-chloranyl-2-methoxy-benzoic acid Openeye Name: ammonia; 5-[1-(3-carboxy-5-chloro-4-methoxy-phenyl)undec-1-enyl]-3-chloro-2-methoxy-benzoic acid CAS Name: ammonia; 5-[1-(3-carboxy-5-chloro-4-methoxyphenyl)undec-1-enyl]-3-chloro-2-methoxybenzoic acid IUPAC Name: azane; 5-[1-(3-carboxy-5-chloro-4-methoxyphenyl)undec-1-enyl]-3-chloro-2-methoxybenzoic acid Traditional Name: ammonia; 5-[1-(3-carboxy-5-chloro-4-methoxy-phenyl)undec-1-enyl]-3-chloro-2-methoxy-benzoic acid Formula: C27H35Cl2NO6 MolecularWeight: 540.4759

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC=C(C1=CC(=C(C(=C1)Cl)OC)C(=O)O)C2=CC(=C(C(=C2)Cl)OC)C(=O)O.N

Isomeric SMILES

CCCCCCCCCC=C(C1=CC(=C(C(=C1)Cl)OC)C(=O)O)C2=CC(=C(C(=C2)Cl)OC)C(=O)O.N

InChI

InChI=1S/C27H32Cl2O6.H3N/c1-4-5-6-7-8-9-10-11-12-19(17-13-20(26(30)31)24(34-2)22(28)15-17)18-14-21(27(32)33)25(35-3)23(29)16-18;/h12-16H,4-11H2,1-3H3,(H,30,31)(H,32,33);1H3