[2-(2-cyanoethylamino)-2-oxidanylidene-ethyl] 4-propan-2-ylbenzoate

Systemtic Name: [2-(2-cyanoethylamino)-2-oxidanylidene-ethyl] 4-propan-2-ylbenzoate Openeye Name: [2-(2-cyanoethylamino)-2-oxo-ethyl] 4-isopropylbenzoate CAS Name: 4-propan-2-ylbenzoic acid [2-(2-cyanoethylamino)-2-oxoethyl] ester IUPAC Name: [2-(2-cyanoethylamino)-2-oxoethyl] 4-propan-2-ylbenzoate Traditional Name: 4-isopropylbenzoic acid [2-(2-cyanoethylamino)-2-keto-ethyl] ester Formula: C15H18N2O3 MolecularWeight: 274.31502

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C(=O)OCC(=O)NCCC#N

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C(=O)OCC(=O)NCCC#N

InChI

InChI=1S/C15H18N2O3/c1-11(2)12-4-6-13(7-5-12)15(19)20-10-14(18)17-9-3-8-16/h4-7,11H,3,9-10H2,1-2H3,(H,17,18)