5-cyano-4-[(2-methoxycarbonylphenyl)diazenyl]pentanoic acid

Systemtic Name: 5-cyano-4-[(2-methoxycarbonylphenyl)diazenyl]pentanoic acid Openeye Name: 5-cyano-4-(2-methoxycarbonylphenyl)azo-pentanoic acid CAS Name: 5-cyano-4-(2-methoxycarbonylphenyl)azopentanoic acid IUPAC Name: 5-cyano-4-[(2-methoxycarbonylphenyl)diazenyl]pentanoic acid Traditional Name: 4-(2-carbomethoxyphenyl)azo-5-cyano-valeric acid Formula: C14H15N3O4 MolecularWeight: 289.2866

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1N=NC(CCC(=O)O)CC#N

Isomeric SMILES

COC(=O)C1=CC=CC=C1N=NC(CCC(=O)O)CC#N

InChI

InChI=1S/C14H15N3O4/c1-21-14(20)11-4-2-3-5-12(11)17-16-10(8-9-15)6-7-13(18)19/h2-5,10H,6-8H2,1H3,(H,18,19)