pentyl 4-[6-azanyl-5-cyano-4-(2,3-dimethoxyphenyl)-3-methyl-4H-pyrano[2,3-c]pyrazol-1-yl]benzoate

Systemtic Name: pentyl 4-[6-azanyl-5-cyano-4-(2,3-dimethoxyphenyl)-3-methyl-4H-pyrano[2,3-c]pyrazol-1-yl]benzoate Openeye Name: pentyl 4-[6-amino-5-cyano-4-(2,3-dimethoxyphenyl)-3-methyl-4H-pyrano[2,3-c]pyrazol-1-yl]benzoate CAS Name: 4-[6-amino-5-cyano-4-(2,3-dimethoxyphenyl)-3-methyl-4H-pyrano[2,3-c]pyrazol-1-yl]benzoic acid pentyl ester IUPAC Name: pentyl 4-[6-amino-5-cyano-4-(2,3-dimethoxyphenyl)-3-methyl-4H-pyrano[2,3-c]pyrazol-1-yl]benzoate Traditional Name: 4-[6-amino-5-cyano-4-(2,3-dimethoxyphenyl)-3-methyl-4H-pyrano[2,3-c]pyrazol-1-yl]benzoic acid amyl ester Formula: C28H30N4O5 MolecularWeight: 502.5616

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC(=O)C1=CC=C(C=C1)N2C3=C(C(C(=C(O3)N)C#N)C4=C(C(=CC=C4)OC)OC)C(=N2)C

Isomeric SMILES

CCCCCOC(=O)C1=CC=C(C=C1)N2C3=C(C(C(=C(O3)N)C#N)C4=C(C(=CC=C4)OC)OC)C(=N2)C

InChI

InChI=1S/C28H30N4O5/c1-5-6-7-15-36-28(33)18-11-13-19(14-12-18)32-27-23(17(2)31-32)24(21(16-29)26(30)37-27)20-9-8-10-22(34-3)25(20)35-4/h8-14,24H,5-7,15,30H2,1-4H3