N4-[4-[bis(azanyl)methylideneamino]phenyl]-N1-[4-[(1-methylpyridin-1-ium-3-yl)carbamoyl]phenyl]benzene-1,4-dicarboxamide

Systemtic Name: N4-[4-[bis(azanyl)methylideneamino]phenyl]-N1-[4-[(1-methylpyridin-1-ium-3-yl)carbamoyl]phenyl]benzene-1,4-dicarboxamide Openeye Name: N4-(4-guanidinophenyl)-N1-[4-[(1-methylpyridin-1-ium-3-yl)carbamoyl]phenyl]terephthalamide CAS Name: N4-[4-(diaminomethylideneamino)phenyl]-N1-[4-[[(1-methyl-3-pyridin-1-iumyl)amino]-oxomethyl]phenyl]benzene-1,4-dicarboxamide IUPAC Name: 4-N-[4-(diaminomethylideneamino)phenyl]-1-N-[4-[(1-methylpyridin-1-ium-3-yl)carbamoyl]phenyl]benzene-1,4-dicarboxamide Traditional Name: N'-(4-guanidinophenyl)-N-[4-[(1-methylpyridin-1-ium-3-yl)carbamoyl]phenyl]terephthalamide Formula: C28H26N7O3+ MolecularWeight: 508.55114

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CC=CC(=C1)NC(=O)C2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)C(=O)NC4=CC=C(C=C4)N=C(N)N

Isomeric SMILES

C[N+]1=CC=CC(=C1)NC(=O)C2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)C(=O)NC4=CC=C(C=C4)N=C(N)N

InChI

InChI=1S/C28H25N7O3/c1-35-16-2-3-24(17-35)33-27(38)20-8-10-21(11-9-20)31-25(36)18-4-6-19(7-5-18)26(37)32-22-12-14-23(15-13-22)34-28(29)30/h2-17H,1H3,(H6-,29,30,31,32,33,34,36,37,38)/p+1