ethyl 4-azanyl-3-cyano-5-(4-methoxyphenyl)-2-phenyl-cyclopenta-1,4-diene-1-carboxylate

Systemtic Name: ethyl 4-azanyl-3-cyano-5-(4-methoxyphenyl)-2-phenyl-cyclopenta-1,4-diene-1-carboxylate Openeye Name: ethyl 4-amino-3-cyano-5-(4-methoxyphenyl)-2-phenyl-cyclopenta-1,4-diene-1-carboxylate CAS Name: 4-amino-3-cyano-5-(4-methoxyphenyl)-2-phenyl-1-cyclopenta-1,4-dienecarboxylic acid ethyl ester IUPAC Name: ethyl 4-amino-3-cyano-5-(4-methoxyphenyl)-2-phenylcyclopenta-1,4-diene-1-carboxylate Traditional Name: 4-amino-3-cyano-5-(4-methoxyphenyl)-2-phenyl-cyclopenta-1,4-diene-1-carboxylic acid ethyl ester Formula: C22H20N2O3 MolecularWeight: 360.4058

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(C(=C1C2=CC=C(C=C2)OC)N)C#N)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=C(C(C(=C1C2=CC=C(C=C2)OC)N)C#N)C3=CC=CC=C3

InChI

InChI=1S/C22H20N2O3/c1-3-27-22(25)20-18(14-7-5-4-6-8-14)17(13-23)21(24)19(20)15-9-11-16(26-2)12-10-15/h4-12,17H,3,24H2,1-2H3