methyl 3-[(5-bromanylfuran-2-yl)carbonylamino]-4-(4-methylpiperazin-1-yl)benzoate

Systemtic Name: methyl 3-[(5-bromanylfuran-2-yl)carbonylamino]-4-(4-methylpiperazin-1-yl)benzoate Openeye Name: methyl 3-[(5-bromofuran-2-carbonyl)amino]-4-(4-methylpiperazin-1-yl)benzoate CAS Name: 3-[[(5-bromo-2-furanyl)-oxomethyl]amino]-4-(4-methyl-1-piperazinyl)benzoic acid methyl ester IUPAC Name: methyl 3-[(5-bromofuran-2-carbonyl)amino]-4-(4-methylpiperazin-1-yl)benzoate Traditional Name: 3-[(5-bromo-2-furoyl)amino]-4-(4-methylpiperazino)benzoic acid methyl ester Formula: C18H20BrN3O4 MolecularWeight: 422.2731

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=C(C=C(C=C2)C(=O)OC)NC(=O)C3=CC=C(O3)Br

Isomeric SMILES

CN1CCN(CC1)C2=C(C=C(C=C2)C(=O)OC)NC(=O)C3=CC=C(O3)Br

InChI

InChI=1S/C18H20BrN3O4/c1-21-7-9-22(10-8-21)14-4-3-12(18(24)25-2)11-13(14)20-17(23)15-5-6-16(19)26-15/h3-6,11H,7-10H2,1-2H3,(H,20,23)