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

Systemtic Name: methyl 4-[6-azanyl-5-cyano-3-methyl-4-(4-nitrophenyl)-4H-pyrano[2,3-c]pyrazol-1-yl]benzoate Openeye Name: methyl 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 methyl ester IUPAC Name: methyl 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 methyl ester Formula: C22H17N5O5 MolecularWeight: 431.40088

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C(C(=C(O2)N)C#N)C3=CC=C(C=C3)[N+](=O)[O-])C4=CC=C(C=C4)C(=O)OC

Isomeric SMILES

CC1=NN(C2=C1C(C(=C(O2)N)C#N)C3=CC=C(C=C3)[N+](=O)[O-])C4=CC=C(C=C4)C(=O)OC

InChI

InChI=1S/C22H17N5O5/c1-12-18-19(13-3-9-16(10-4-13)27(29)30)17(11-23)20(24)32-21(18)26(25-12)15-7-5-14(6-8-15)22(28)31-2/h3-10,19H,24H2,1-2H3