diethyl 2-[4-azanyl-2-cyano-3-(methylamino)phenyl]-2-ethanoyl-pentanedioate

Systemtic Name: diethyl 2-[4-azanyl-2-cyano-3-(methylamino)phenyl]-2-ethanoyl-pentanedioate Openeye Name: diethyl 2-acetyl-2-[4-amino-2-cyano-3-(methylamino)phenyl]pentanedioate CAS Name: 2-acetyl-2-[4-amino-2-cyano-3-(methylamino)phenyl]pentanedioic acid diethyl ester IUPAC Name: diethyl 2-acetyl-2-[4-amino-2-cyano-3-(methylamino)phenyl]pentanedioate Traditional Name: 2-acetyl-2-[4-amino-2-cyano-3-(methylamino)phenyl]glutaric acid diethyl ester Formula: C19H25N3O5 MolecularWeight: 375.4189

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC(C1=C(C(=C(C=C1)N)NC)C#N)(C(=O)C)C(=O)OCC

Isomeric SMILES

CCOC(=O)CCC(C1=C(C(=C(C=C1)N)NC)C#N)(C(=O)C)C(=O)OCC

InChI

InChI=1S/C19H25N3O5/c1-5-26-16(24)9-10-19(12(3)23,18(25)27-6-2)14-7-8-15(21)17(22-4)13(14)11-20/h7-8,22H,5-6,9-10,21H2,1-4H3