[4-(6-azanyl-5-cyano-3-propyl-2,4-dihydropyrano[2,3-c]pyrazol-4-yl)-2-methoxy-phenyl] 2-methyl-3-nitro-benzoate

Systemtic Name: [4-(6-azanyl-5-cyano-3-propyl-2,4-dihydropyrano[2,3-c]pyrazol-4-yl)-2-methoxy-phenyl] 2-methyl-3-nitro-benzoate Openeye Name: [4-(6-amino-5-cyano-3-propyl-2,4-dihydropyrano[2,3-c]pyrazol-4-yl)-2-methoxy-phenyl] 2-methyl-3-nitro-benzoate CAS Name: 2-methyl-3-nitrobenzoic acid [4-(6-amino-5-cyano-3-propyl-2,4-dihydropyrano[2,3-c]pyrazol-4-yl)-2-methoxyphenyl] ester IUPAC Name: [4-(6-amino-5-cyano-3-propyl-2,4-dihydropyrano[2,3-c]pyrazol-4-yl)-2-methoxyphenyl] 2-methyl-3-nitrobenzoate Traditional Name: 2-methyl-3-nitro-benzoic acid [4-(6-amino-5-cyano-3-propyl-2,4-dihydropyrano[2,3-c]pyrazol-4-yl)-2-methoxy-phenyl] ester Formula: C25H23N5O6 MolecularWeight: 489.48002

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C2C(C(=C(OC2=NN1)N)C#N)C3=CC(=C(C=C3)OC(=O)C4=C(C(=CC=C4)[N+](=O)[O-])C)OC

Isomeric SMILES

CCCC1=C2C(C(=C(OC2=NN1)N)C#N)C3=CC(=C(C=C3)OC(=O)C4=C(C(=CC=C4)[N+](=O)[O-])C)OC

InChI

InChI=1S/C25H23N5O6/c1-4-6-17-22-21(16(12-26)23(27)36-24(22)29-28-17)14-9-10-19(20(11-14)34-3)35-25(31)15-7-5-8-18(13(15)2)30(32)33/h5,7-11,21H,4,6,27H2,1-3H3,(H,28,29)