propyl 4-[(4-tert-butylphenyl)-(cyanomethyl)amino]-4-oxidanylidene-butanoate

Systemtic Name: propyl 4-[(4-tert-butylphenyl)-(cyanomethyl)amino]-4-oxidanylidene-butanoate Openeye Name: propyl 4-[4-tert-butyl-N-(cyanomethyl)anilino]-4-oxo-butanoate CAS Name: 4-[4-tert-butyl-N-(cyanomethyl)anilino]-4-oxobutanoic acid propyl ester IUPAC Name: propyl 4-[4-tert-butyl-N-(cyanomethyl)anilino]-4-oxobutanoate Traditional Name: 4-[4-tert-butyl-N-(cyanomethyl)anilino]-4-keto-butyric acid propyl ester Formula: C19H26N2O3 MolecularWeight: 330.42134

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)CCC(=O)N(CC#N)C1=CC=C(C=C1)C(C)(C)C

Isomeric SMILES

CCCOC(=O)CCC(=O)N(CC#N)C1=CC=C(C=C1)C(C)(C)C

InChI

InChI=1S/C19H26N2O3/c1-5-14-24-18(23)11-10-17(22)21(13-12-20)16-8-6-15(7-9-16)19(2,3)4/h6-9H,5,10-11,13-14H2,1-4H3