4-[(2-cyanophenyl)amino]-2,2-diethyl-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[(2-cyanophenyl)amino]-2,2-diethyl-4-oxidanylidene-butanoic acid Openeye Name: 4-(2-cyanoanilino)-2,2-diethyl-4-oxo-butanoic acid CAS Name: 4-(2-cyanoanilino)-2,2-diethyl-4-oxobutanoic acid IUPAC Name: 4-(2-cyanoanilino)-2,2-diethyl-4-oxobutanoic acid Traditional Name: 4-(2-cyanoanilino)-2,2-diethyl-4-keto-butyric acid Formula: C15H18N2O3 MolecularWeight: 274.31502

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(CC(=O)NC1=CC=CC=C1C#N)C(=O)O

Isomeric SMILES

CCC(CC)(CC(=O)NC1=CC=CC=C1C#N)C(=O)O

InChI

InChI=1S/C15H18N2O3/c1-3-15(4-2,14(19)20)9-13(18)17-12-8-6-5-7-11(12)10-16/h5-8H,3-4,9H2,1-2H3,(H,17,18)(H,19,20)