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

Systemtic Name: pentyl 4-(6-azanyl-5-cyano-3-methyl-4-phenyl-4H-pyrano[2,3-c]pyrazol-1-yl)benzoate Openeye Name: pentyl 4-(6-amino-5-cyano-3-methyl-4-phenyl-4H-pyrano[2,3-c]pyrazol-1-yl)benzoate CAS Name: 4-(6-amino-5-cyano-3-methyl-4-phenyl-4H-pyrano[2,3-c]pyrazol-1-yl)benzoic acid pentyl ester IUPAC Name: pentyl 4-(6-amino-5-cyano-3-methyl-4-phenyl-4H-pyrano[2,3-c]pyrazol-1-yl)benzoate Traditional Name: 4-(6-amino-5-cyano-3-methyl-4-phenyl-4H-pyrano[2,3-c]pyrazol-1-yl)benzoic acid amyl ester Formula: C26H26N4O3 MolecularWeight: 442.50964

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC(=O)C1=CC=C(C=C1)N2C3=C(C(C(=C(O3)N)C#N)C4=CC=CC=C4)C(=N2)C

Isomeric SMILES

CCCCCOC(=O)C1=CC=C(C=C1)N2C3=C(C(C(=C(O3)N)C#N)C4=CC=CC=C4)C(=N2)C

InChI

InChI=1S/C26H26N4O3/c1-3-4-8-15-32-26(31)19-11-13-20(14-12-19)30-25-22(17(2)29-30)23(18-9-6-5-7-10-18)21(16-27)24(28)33-25/h5-7,9-14,23H,3-4,8,15,28H2,1-2H3