methyl 6-[(3-methyl-1-phenyl-5-pyrrol-1-yl-pyrazol-4-yl)carbonylamino]-1,3-benzodioxole-5-carboxylate

Systemtic Name: methyl 6-[(3-methyl-1-phenyl-5-pyrrol-1-yl-pyrazol-4-yl)carbonylamino]-1,3-benzodioxole-5-carboxylate Openeye Name: methyl 6-[(3-methyl-1-phenyl-5-pyrrol-1-yl-pyrazole-4-carbonyl)amino]-1,3-benzodioxole-5-carboxylate CAS Name: 6-[[[3-methyl-1-phenyl-5-(1-pyrrolyl)-4-pyrazolyl]-oxomethyl]amino]-1,3-benzodioxole-5-carboxylic acid methyl ester IUPAC Name: methyl 6-[(3-methyl-1-phenyl-5-pyrrol-1-ylpyrazole-4-carbonyl)amino]-1,3-benzodioxole-5-carboxylate Traditional Name: 6-[(3-methyl-1-phenyl-5-pyrrol-1-yl-pyrazole-4-carbonyl)amino]-piperonylic acid methyl ester Formula: C24H20N4O5 MolecularWeight: 444.4394

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)NC2=CC3=C(C=C2C(=O)OC)OCO3)N4C=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CC1=NN(C(=C1C(=O)NC2=CC3=C(C=C2C(=O)OC)OCO3)N4C=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C24H20N4O5/c1-15-21(23(27-10-6-7-11-27)28(26-15)16-8-4-3-5-9-16)22(29)25-18-13-20-19(32-14-33-20)12-17(18)24(30)31-2/h3-13H,14H2,1-2H3,(H,25,29)