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

Systemtic Name: azane; 5-[1-(3-carboxy-5-chloranyl-4-methoxy-phenyl)hept-1-enyl]-3-chloranyl-2-methoxy-benzoic acid Openeye Name: ammonia; 5-[1-(3-carboxy-5-chloro-4-methoxy-phenyl)hept-1-enyl]-3-chloro-2-methoxy-benzoic acid CAS Name: ammonia; 5-[1-(3-carboxy-5-chloro-4-methoxyphenyl)hept-1-enyl]-3-chloro-2-methoxybenzoic acid IUPAC Name: azane; 5-[1-(3-carboxy-5-chloro-4-methoxyphenyl)hept-1-enyl]-3-chloro-2-methoxybenzoic acid Traditional Name: ammonia; 5-[1-(3-carboxy-5-chloro-4-methoxy-phenyl)hept-1-enyl]-3-chloro-2-methoxy-benzoic acid Formula: C23H27Cl2NO6 MolecularWeight: 484.36958

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCCCCC=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/C23H24Cl2O6.H3N/c1-4-5-6-7-8-15(13-9-16(22(26)27)20(30-2)18(24)11-13)14-10-17(23(28)29)21(31-3)19(25)12-14;/h8-12H,4-7H2,1-3H3,(H,26,27)(H,28,29);1H3