5-[4-azido-1-(3-carboxy-5-chloranyl-4-methoxy-phenyl)but-1-enyl]-3-chloranyl-2-methoxy-benzoic acid

Systemtic Name: 5-[4-azido-1-(3-carboxy-5-chloranyl-4-methoxy-phenyl)but-1-enyl]-3-chloranyl-2-methoxy-benzoic acid Openeye Name: 5-[4-azido-1-(3-carboxy-5-chloro-4-methoxy-phenyl)but-1-enyl]-3-chloro-2-methoxy-benzoic acid CAS Name: 5-[4-azido-1-(3-carboxy-5-chloro-4-methoxyphenyl)but-1-enyl]-3-chloro-2-methoxybenzoic acid IUPAC Name: 5-[4-azido-1-(3-carboxy-5-chloro-4-methoxyphenyl)but-1-enyl]-3-chloro-2-methoxybenzoic acid Traditional Name: 5-[4-azido-1-(3-carboxy-5-chloro-4-methoxy-phenyl)but-1-enyl]-3-chloro-2-methoxy-benzoic acid Formula: C20H17Cl2N3O6 MolecularWeight: 466.27148

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1Cl)C(=CCCN=[N+]=[N-])C2=CC(=C(C(=C2)Cl)OC)C(=O)O)C(=O)O

Isomeric SMILES

COC1=C(C=C(C=C1Cl)C(=CCCN=[N+]=[N-])C2=CC(=C(C(=C2)Cl)OC)C(=O)O)C(=O)O

InChI

InChI=1S/C20H17Cl2N3O6/c1-30-17-13(19(26)27)6-10(8-15(17)21)12(4-3-5-24-25-23)11-7-14(20(28)29)18(31-2)16(22)9-11/h4,6-9H,3,5H2,1-2H3,(H,26,27)(H,28,29)