4-(6-azanyl-5-cyano-3-methyl-1-naphthalen-2-yl-4H-pyrano[2,3-c]pyrazol-4-yl)benzoic acid

Systemtic Name: 4-(6-azanyl-5-cyano-3-methyl-1-naphthalen-2-yl-4H-pyrano[2,3-c]pyrazol-4-yl)benzoic acid Openeye Name: 4-[6-amino-5-cyano-3-methyl-1-(2-naphthyl)-4H-pyrano[2,3-c]pyrazol-4-yl]benzoic acid CAS Name: 4-[6-amino-5-cyano-3-methyl-1-(2-naphthalenyl)-4H-pyrano[2,3-c]pyrazol-4-yl]benzoic acid IUPAC Name: 4-(6-amino-5-cyano-3-methyl-1-naphthalen-2-yl-4H-pyrano[2,3-c]pyrazol-4-yl)benzoic acid Traditional Name: 4-[6-amino-5-cyano-3-methyl-1-(2-naphthyl)-4H-pyrano[2,3-c]pyrazol-4-yl]benzoic acid Formula: C25H18N4O3 MolecularWeight: 422.43542

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)C(=O)O)C4=CC5=CC=CC=C5C=C4

Isomeric SMILES

CC1=NN(C2=C1C(C(=C(O2)N)C#N)C3=CC=C(C=C3)C(=O)O)C4=CC5=CC=CC=C5C=C4

InChI

InChI=1S/C25H18N4O3/c1-14-21-22(16-6-8-17(9-7-16)25(30)31)20(13-26)23(27)32-24(21)29(28-14)19-11-10-15-4-2-3-5-18(15)12-19/h2-12,22H,27H2,1H3,(H,30,31)