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

Systemtic Name: butyl 4-[6-azanyl-5-cyano-3-methyl-4-(4-nitrophenyl)-4H-pyrano[2,3-c]pyrazol-1-yl]benzoate Openeye Name: butyl 4-[6-amino-5-cyano-3-methyl-4-(4-nitrophenyl)-4H-pyrano[2,3-c]pyrazol-1-yl]benzoate CAS Name: 4-[6-amino-5-cyano-3-methyl-4-(4-nitrophenyl)-4H-pyrano[2,3-c]pyrazol-1-yl]benzoic acid butyl ester IUPAC Name: butyl 4-[6-amino-5-cyano-3-methyl-4-(4-nitrophenyl)-4H-pyrano[2,3-c]pyrazol-1-yl]benzoate Traditional Name: 4-[6-amino-5-cyano-3-methyl-4-(4-nitrophenyl)-4H-pyrano[2,3-c]pyrazol-1-yl]benzoic acid butyl ester Formula: C25H23N5O5 MolecularWeight: 473.48062

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)N2C3=C(C(C(=C(O3)N)C#N)C4=CC=C(C=C4)[N+](=O)[O-])C(=N2)C

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)N2C3=C(C(C(=C(O3)N)C#N)C4=CC=C(C=C4)[N+](=O)[O-])C(=N2)C

InChI

InChI=1S/C25H23N5O5/c1-3-4-13-34-25(31)17-7-9-18(10-8-17)29-24-21(15(2)28-29)22(20(14-26)23(27)35-24)16-5-11-19(12-6-16)30(32)33/h5-12,22H,3-4,13,27H2,1-2H3