ethyl 3-(2-cyanoethanoylamino)-4-(ethylamino)benzoate

Systemtic Name: ethyl 3-(2-cyanoethanoylamino)-4-(ethylamino)benzoate Openeye Name: ethyl 3-[(2-cyanoacetyl)amino]-4-(ethylamino)benzoate CAS Name: 3-[(2-cyano-1-oxoethyl)amino]-4-(ethylamino)benzoic acid ethyl ester IUPAC Name: ethyl 3-[(2-cyanoacetyl)amino]-4-(ethylamino)benzoate Traditional Name: 3-[(2-cyanoacetyl)amino]-4-(ethylamino)benzoic acid ethyl ester Formula: C14H17N3O3 MolecularWeight: 275.30308

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=C(C=C(C=C1)C(=O)OCC)NC(=O)CC#N

Isomeric SMILES

CCNC1=C(C=C(C=C1)C(=O)OCC)NC(=O)CC#N

InChI

InChI=1S/C14H17N3O3/c1-3-16-11-6-5-10(14(19)20-4-2)9-12(11)17-13(18)7-8-15/h5-6,9,16H,3-4,7H2,1-2H3,(H,17,18)