2-[2-(6-azanyl-5-cyano-3-methyl-2,4-dihydropyrano[2,3-c]pyrazol-4-yl)phenoxy]ethanoic acid

Systemtic Name: 2-[2-(6-azanyl-5-cyano-3-methyl-2,4-dihydropyrano[2,3-c]pyrazol-4-yl)phenoxy]ethanoic acid Openeye Name: 2-[2-(6-amino-5-cyano-3-methyl-2,4-dihydropyrano[2,3-c]pyrazol-4-yl)phenoxy]acetic acid CAS Name: 2-[2-(6-amino-5-cyano-3-methyl-2,4-dihydropyrano[2,3-c]pyrazol-4-yl)phenoxy]acetic acid IUPAC Name: 2-[2-(6-amino-5-cyano-3-methyl-2,4-dihydropyrano[2,3-c]pyrazol-4-yl)phenoxy]acetic acid Traditional Name: 2-[2-(6-amino-5-cyano-3-methyl-2,4-dihydropyrano[2,3-c]pyrazol-4-yl)phenoxy]acetic acid Formula: C16H14N4O4 MolecularWeight: 326.30676

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(C(=C(OC2=NN1)N)C#N)C3=CC=CC=C3OCC(=O)O

Isomeric SMILES

CC1=C2C(C(=C(OC2=NN1)N)C#N)C3=CC=CC=C3OCC(=O)O

InChI

InChI=1S/C16H14N4O4/c1-8-13-14(10(6-17)15(18)24-16(13)20-19-8)9-4-2-3-5-11(9)23-7-12(21)22/h2-5,14H,7,18H2,1H3,(H,19,20)(H,21,22)