methyl 2-[6-azanyl-5-cyano-4-(4-cyclopentyloxyphenyl)-2,4-dihydropyrano[2,3-c]pyrazol-3-yl]ethanoate

Systemtic Name: methyl 2-[6-azanyl-5-cyano-4-(4-cyclopentyloxyphenyl)-2,4-dihydropyrano[2,3-c]pyrazol-3-yl]ethanoate Openeye Name: methyl 2-[6-amino-5-cyano-4-[4-(cyclopentoxy)phenyl]-2,4-dihydropyrano[2,3-c]pyrazol-3-yl]acetate CAS Name: 2-[6-amino-5-cyano-4-(4-cyclopentyloxyphenyl)-2,4-dihydropyrano[2,3-c]pyrazol-3-yl]acetic acid methyl ester IUPAC Name: methyl 2-[6-amino-5-cyano-4-(4-cyclopentyloxyphenyl)-2,4-dihydropyrano[2,3-c]pyrazol-3-yl]acetate Traditional Name: 2-[6-amino-5-cyano-4-[4-(cyclopentoxy)phenyl]-2,4-dihydropyrano[2,3-c]pyrazol-3-yl]acetic acid methyl ester Formula: C21H22N4O4 MolecularWeight: 394.42378

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1=C2C(C(=C(OC2=NN1)N)C#N)C3=CC=C(C=C3)OC4CCCC4

Isomeric SMILES

COC(=O)CC1=C2C(C(=C(OC2=NN1)N)C#N)C3=CC=C(C=C3)OC4CCCC4

InChI

InChI=1S/C21H22N4O4/c1-27-17(26)10-16-19-18(15(11-22)20(23)29-21(19)25-24-16)12-6-8-14(9-7-12)28-13-4-2-3-5-13/h6-9,13,18H,2-5,10,23H2,1H3,(H,24,25)