8-[(4-cyanophenyl)-methyl-amino]-8-oxidanylidene-octanoic acid

Systemtic Name: 8-[(4-cyanophenyl)-methyl-amino]-8-oxidanylidene-octanoic acid Openeye Name: 8-(4-cyano-N-methyl-anilino)-8-oxo-octanoic acid CAS Name: 8-(4-cyano-N-methylanilino)-8-oxooctanoic acid IUPAC Name: 8-(4-cyano-N-methylanilino)-8-oxooctanoic acid Traditional Name: 8-(4-cyano-N-methyl-anilino)-8-keto-caprylic acid Formula: C16H20N2O3 MolecularWeight: 288.3416

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=C(C=C1)C#N)C(=O)CCCCCCC(=O)O

Isomeric SMILES

CN(C1=CC=C(C=C1)C#N)C(=O)CCCCCCC(=O)O

InChI

InChI=1S/C16H20N2O3/c1-18(14-10-8-13(12-17)9-11-14)15(19)6-4-2-3-5-7-16(20)21/h8-11H,2-7H2,1H3,(H,20,21)