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

Systemtic Name: 2-methylpropyl 4-[6-azanyl-5-cyano-4-(2,3-dimethoxyphenyl)-3-methyl-4H-pyrano[2,3-c]pyrazol-1-yl]benzoate Openeye Name: isobutyl 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 2-methylpropyl ester IUPAC Name: 2-methylpropyl 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 isobutyl ester Formula: C27H28N4O5 MolecularWeight: 488.53502

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H28N4O5/c1-15(2)14-35-27(32)17-9-11-18(12-10-17)31-26-22(16(3)30-31)23(20(13-28)25(29)36-26)19-7-6-8-21(33-4)24(19)34-5/h6-12,15,23H,14,29H2,1-5H3