methyl 3-[(2-chloranylpyridin-3-yl)carbonylamino]-4-(4-methylpiperazin-1-yl)benzoate

Systemtic Name: methyl 3-[(2-chloranylpyridin-3-yl)carbonylamino]-4-(4-methylpiperazin-1-yl)benzoate Openeye Name: methyl 3-[(2-chloropyridine-3-carbonyl)amino]-4-(4-methylpiperazin-1-yl)benzoate CAS Name: 3-[[(2-chloro-3-pyridinyl)-oxomethyl]amino]-4-(4-methyl-1-piperazinyl)benzoic acid methyl ester IUPAC Name: methyl 3-[(2-chloropyridine-3-carbonyl)amino]-4-(4-methylpiperazin-1-yl)benzoate Traditional Name: 3-[(2-chloronicotinoyl)amino]-4-(4-methylpiperazino)benzoic acid methyl ester Formula: C19H21ClN4O3 MolecularWeight: 388.84804

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=C(C=C(C=C2)C(=O)OC)NC(=O)C3=C(N=CC=C3)Cl

Isomeric SMILES

CN1CCN(CC1)C2=C(C=C(C=C2)C(=O)OC)NC(=O)C3=C(N=CC=C3)Cl

InChI

InChI=1S/C19H21ClN4O3/c1-23-8-10-24(11-9-23)16-6-5-13(19(26)27-2)12-15(16)22-18(25)14-4-3-7-21-17(14)20/h3-7,12H,8-11H2,1-2H3,(H,22,25)