methyl 4-[3-[[(2-chloranylpyridin-3-yl)carbonylhydrazinylidene]methyl]-2,5-dimethyl-pyrrol-1-yl]benzoate

Systemtic Name: methyl 4-[3-[[(2-chloranylpyridin-3-yl)carbonylhydrazinylidene]methyl]-2,5-dimethyl-pyrrol-1-yl]benzoate Openeye Name: methyl 4-[3-[[(2-chloropyridine-3-carbonyl)hydrazono]methyl]-2,5-dimethyl-pyrrol-1-yl]benzoate CAS Name: 4-[3-[[[(2-chloro-3-pyridinyl)-oxomethyl]hydrazinylidene]methyl]-2,5-dimethyl-1-pyrrolyl]benzoic acid methyl ester IUPAC Name: methyl 4-[3-[[(2-chloropyridine-3-carbonyl)hydrazinylidene]methyl]-2,5-dimethylpyrrol-1-yl]benzoate Traditional Name: 4-[3-[[(2-chloronicotinoyl)hydrazono]methyl]-2,5-dimethyl-pyrrol-1-yl]benzoic acid methyl ester Formula: C21H19ClN4O3 MolecularWeight: 410.85356

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=C(C=C2)C(=O)OC)C)C=NNC(=O)C3=C(N=CC=C3)Cl

Isomeric SMILES

CC1=CC(=C(N1C2=CC=C(C=C2)C(=O)OC)C)C=NNC(=O)C3=C(N=CC=C3)Cl

InChI

InChI=1S/C21H19ClN4O3/c1-13-11-16(12-24-25-20(27)18-5-4-10-23-19(18)22)14(2)26(13)17-8-6-15(7-9-17)21(28)29-3/h4-12H,1-3H3,(H,25,27)