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

Systemtic Name: 2-methylpropyl 4-[6-azanyl-5-cyano-4-(4-hydroxyphenyl)-3-methyl-4H-pyrano[2,3-c]pyrazol-1-yl]benzoate Openeye Name: isobutyl 4-[6-amino-5-cyano-4-(4-hydroxyphenyl)-3-methyl-4H-pyrano[2,3-c]pyrazol-1-yl]benzoate CAS Name: 4-[6-amino-5-cyano-4-(4-hydroxyphenyl)-3-methyl-4H-pyrano[2,3-c]pyrazol-1-yl]benzoic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 4-[6-amino-5-cyano-4-(4-hydroxyphenyl)-3-methyl-4H-pyrano[2,3-c]pyrazol-1-yl]benzoate Traditional Name: 4-[6-amino-5-cyano-4-(4-hydroxyphenyl)-3-methyl-4H-pyrano[2,3-c]pyrazol-1-yl]benzoic acid isobutyl ester Formula: C25H24N4O4 MolecularWeight: 444.48246

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C(C(=C(O2)N)C#N)C3=CC=C(C=C3)O)C4=CC=C(C=C4)C(=O)OCC(C)C

Isomeric SMILES

CC1=NN(C2=C1C(C(=C(O2)N)C#N)C3=CC=C(C=C3)O)C4=CC=C(C=C4)C(=O)OCC(C)C

InChI

InChI=1S/C25H24N4O4/c1-14(2)13-32-25(31)17-4-8-18(9-5-17)29-24-21(15(3)28-29)22(20(12-26)23(27)33-24)16-6-10-19(30)11-7-16/h4-11,14,22,30H,13,27H2,1-3H3