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

Systemtic Name: methyl 2-[6-azanyl-4-(3-bromanyl-4-methoxy-phenyl)-5-cyano-2,4-dihydropyrano[2,3-c]pyrazol-3-yl]ethanoate Openeye Name: methyl 2-[6-amino-4-(3-bromo-4-methoxy-phenyl)-5-cyano-2,4-dihydropyrano[2,3-c]pyrazol-3-yl]acetate CAS Name: 2-[6-amino-4-(3-bromo-4-methoxyphenyl)-5-cyano-2,4-dihydropyrano[2,3-c]pyrazol-3-yl]acetic acid methyl ester IUPAC Name: methyl 2-[6-amino-4-(3-bromo-4-methoxyphenyl)-5-cyano-2,4-dihydropyrano[2,3-c]pyrazol-3-yl]acetate Traditional Name: 2-[6-amino-4-(3-bromo-4-methoxy-phenyl)-5-cyano-2,4-dihydropyrano[2,3-c]pyrazol-3-yl]acetic acid methyl ester Formula: C17H15BrN4O4 MolecularWeight: 419.2294

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2C(=C(OC3=NNC(=C23)CC(=O)OC)N)C#N)Br

Isomeric SMILES

COC1=C(C=C(C=C1)C2C(=C(OC3=NNC(=C23)CC(=O)OC)N)C#N)Br

InChI

InChI=1S/C17H15BrN4O4/c1-24-12-4-3-8(5-10(12)18)14-9(7-19)16(20)26-17-15(14)11(21-22-17)6-13(23)25-2/h3-5,14H,6,20H2,1-2H3,(H,21,22)