ethyl (1E)-N-[3-cyano-4-(4-methoxyphenyl)-7-oxidanyl-4H-chromen-2-yl]methanimidate

Systemtic Name: ethyl (1E)-N-[3-cyano-4-(4-methoxyphenyl)-7-oxidanyl-4H-chromen-2-yl]methanimidate Openeye Name: ethyl (1E)-N-[3-cyano-7-hydroxy-4-(4-methoxyphenyl)-4H-chromen-2-yl]methanimidate CAS Name: (1E)-N-[3-cyano-7-hydroxy-4-(4-methoxyphenyl)-4H-1-benzopyran-2-yl]methanimidic acid ethyl ester IUPAC Name: ethyl (1E)-N-[3-cyano-7-hydroxy-4-(4-methoxyphenyl)-4H-chromen-2-yl]methanimidate Traditional Name: (1E)-N-[3-cyano-7-hydroxy-4-(4-methoxyphenyl)-4H-chromen-2-yl]formimidic acid ethyl ester Formula: C20H18N2O4 MolecularWeight: 350.36792

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC=NC1=C(C(C2=C(O1)C=C(C=C2)O)C3=CC=C(C=C3)OC)C#N

Isomeric SMILES

CCO/C=N/C1=C(C(C2=C(O1)C=C(C=C2)O)C3=CC=C(C=C3)OC)C#N

InChI

InChI=1S/C20H18N2O4/c1-3-25-12-22-20-17(11-21)19(13-4-7-15(24-2)8-5-13)16-9-6-14(23)10-18(16)26-20/h4-10,12,19,23H,3H2,1-2H3/b22-12+