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

Systemtic Name: methyl 3-[(5-bromanylfuran-2-yl)carbonylamino]-4-(4-ethylpiperazin-1-yl)benzoate Openeye Name: methyl 3-[(5-bromofuran-2-carbonyl)amino]-4-(4-ethylpiperazin-1-yl)benzoate CAS Name: 3-[[(5-bromo-2-furanyl)-oxomethyl]amino]-4-(4-ethyl-1-piperazinyl)benzoic acid methyl ester IUPAC Name: methyl 3-[(5-bromofuran-2-carbonyl)amino]-4-(4-ethylpiperazin-1-yl)benzoate Traditional Name: 3-[(5-bromo-2-furoyl)amino]-4-(4-ethylpiperazino)benzoic acid methyl ester Formula: C19H22BrN3O4 MolecularWeight: 436.29968

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=C(C=C(C=C2)C(=O)OC)NC(=O)C3=CC=C(O3)Br

Isomeric SMILES

CCN1CCN(CC1)C2=C(C=C(C=C2)C(=O)OC)NC(=O)C3=CC=C(O3)Br

InChI

InChI=1S/C19H22BrN3O4/c1-3-22-8-10-23(11-9-22)15-5-4-13(19(25)26-2)12-14(15)21-18(24)16-6-7-17(20)27-16/h4-7,12H,3,8-11H2,1-2H3,(H,21,24)