N1-(4-carbamimidoylphenyl)-N4-[4-[(1-methylpyridin-1-ium-2-yl)carbamoyl]phenyl]benzene-1,4-dicarboxamide

Systemtic Name: N1-(4-carbamimidoylphenyl)-N4-[4-[(1-methylpyridin-1-ium-2-yl)carbamoyl]phenyl]benzene-1,4-dicarboxamide Openeye Name: N1-(4-carbamimidoylphenyl)-N4-[4-[(1-methylpyridin-1-ium-2-yl)carbamoyl]phenyl]terephthalamide CAS Name: N1-(4-carbamimidoylphenyl)-N4-[4-[[(1-methyl-2-pyridin-1-iumyl)amino]-oxomethyl]phenyl]benzene-1,4-dicarboxamide IUPAC Name: 1-N-(4-carbamimidoylphenyl)-4-N-[4-[(1-methylpyridin-1-ium-2-yl)carbamoyl]phenyl]benzene-1,4-dicarboxamide Traditional Name: N-(4-amidinophenyl)-N'-[4-[(1-methylpyridin-1-ium-2-yl)carbamoyl]phenyl]terephthalamide Formula: C28H25N6O3+ MolecularWeight: 493.5365

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CC=CC=C1NC(=O)C2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)C(=O)NC4=CC=C(C=C4)C(=N)N

Isomeric SMILES

C[N+]1=CC=CC=C1NC(=O)C2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)C(=O)NC4=CC=C(C=C4)C(=N)N

InChI

InChI=1S/C28H24N6O3/c1-34-17-3-2-4-24(34)33-28(37)21-11-15-23(16-12-21)32-27(36)20-7-5-19(6-8-20)26(35)31-22-13-9-18(10-14-22)25(29)30/h2-17H,1H3,(H5,29,30,31,32,35,36,37)/p+1