ethyl 3-(cyanomethyl)-5-(dipropylcarbamoyl)benzoate

Systemtic Name: ethyl 3-(cyanomethyl)-5-(dipropylcarbamoyl)benzoate Openeye Name: ethyl 3-(cyanomethyl)-5-(dipropylcarbamoyl)benzoate CAS Name: 3-(cyanomethyl)-5-[(dipropylamino)-oxomethyl]benzoic acid ethyl ester IUPAC Name: ethyl 3-(cyanomethyl)-5-(dipropylcarbamoyl)benzoate Traditional Name: 3-(cyanomethyl)-5-(dipropylcarbamoyl)benzoic acid ethyl ester Formula: C18H24N2O3 MolecularWeight: 316.39476

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC)C(=O)C1=CC(=CC(=C1)CC#N)C(=O)OCC

Isomeric SMILES

CCCN(CCC)C(=O)C1=CC(=CC(=C1)CC#N)C(=O)OCC

InChI

InChI=1S/C18H24N2O3/c1-4-9-20(10-5-2)17(21)15-11-14(7-8-19)12-16(13-15)18(22)23-6-3/h11-13H,4-7,9-10H2,1-3H3