ethyl 2-[4-azanyl-2-cyano-3-(ethylamino)phenyl]-2-methyl-3-oxidanylidene-butanoate

Systemtic Name: ethyl 2-[4-azanyl-2-cyano-3-(ethylamino)phenyl]-2-methyl-3-oxidanylidene-butanoate Openeye Name: ethyl 2-[4-amino-2-cyano-3-(ethylamino)phenyl]-2-methyl-3-oxo-butanoate CAS Name: 2-[4-amino-2-cyano-3-(ethylamino)phenyl]-2-methyl-3-oxobutanoic acid ethyl ester IUPAC Name: ethyl 2-[4-amino-2-cyano-3-(ethylamino)phenyl]-2-methyl-3-oxobutanoate Traditional Name: 2-[4-amino-2-cyano-3-(ethylamino)phenyl]-3-keto-2-methyl-butyric acid ethyl ester Formula: C16H21N3O3 MolecularWeight: 303.35624

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=C(C=CC(=C1C#N)C(C)(C(=O)C)C(=O)OCC)N

Isomeric SMILES

CCNC1=C(C=CC(=C1C#N)C(C)(C(=O)C)C(=O)OCC)N

InChI

InChI=1S/C16H21N3O3/c1-5-19-14-11(9-17)12(7-8-13(14)18)16(4,10(3)20)15(21)22-6-2/h7-8,19H,5-6,18H2,1-4H3