ethyl 4-(3-azanyl-4-cyano-phenyl)benzoate

Systemtic Name: ethyl 4-(3-azanyl-4-cyano-phenyl)benzoate Openeye Name: ethyl 4-(3-amino-4-cyano-phenyl)benzoate CAS Name: 4-(3-amino-4-cyanophenyl)benzoic acid ethyl ester IUPAC Name: ethyl 4-(3-amino-4-cyanophenyl)benzoate Traditional Name: 4-(3-amino-4-cyano-phenyl)benzoic acid ethyl ester Formula: C16H14N2O2 MolecularWeight: 266.29456

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)C2=CC(=C(C=C2)C#N)N

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)C2=CC(=C(C=C2)C#N)N

InChI

InChI=1S/C16H14N2O2/c1-2-20-16(19)12-5-3-11(4-6-12)13-7-8-14(10-17)15(18)9-13/h3-9H,2,18H2,1H3