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

Systemtic Name: N1-[4-[(E)-N-[bis(azanyl)methylideneamino]-C-methyl-carbonimidoyl]phenyl]-N4-[4-[(1-methylpyridin-1-ium-3-yl)carbamoyl]phenyl]benzene-1,4-dicarboxamide Openeye Name: N1-[4-[(E)-N-guanidino-C-methyl-carbonimidoyl]phenyl]-N4-[4-[(1-methylpyridin-1-ium-3-yl)carbamoyl]phenyl]terephthalamide CAS Name: N1-[4-[(1E)-1-(diaminomethylidenehydrazinylidene)ethyl]phenyl]-N4-[4-[[(1-methyl-3-pyridin-1-iumyl)amino]-oxomethyl]phenyl]benzene-1,4-dicarboxamide IUPAC Name: 1-N-[4-[(E)-N-(diaminomethylideneamino)-C-methylcarbonimidoyl]phenyl]-4-N-[4-[(1-methylpyridin-1-ium-3-yl)carbamoyl]phenyl]benzene-1,4-dicarboxamide Traditional Name: N-[4-[(E)-N-guanidino-C-methyl-carbonimidoyl]phenyl]-N'-[4-[(1-methylpyridin-1-ium-3-yl)carbamoyl]phenyl]terephthalamide Formula: C30H29N8O3+ MolecularWeight: 549.60306

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NN=C(N)N)C1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)C(=O)NC3=CC=C(C=C3)C(=O)NC4=C[N+](=CC=C4)C

Isomeric SMILES

C/C(=N\N=C(N)N)/C1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)C(=O)NC3=CC=C(C=C3)C(=O)NC4=C[N+](=CC=C4)C

InChI

InChI=1S/C30H28N8O3/c1-19(36-37-30(31)32)20-9-13-24(14-10-20)33-27(39)21-5-7-22(8-6-21)28(40)34-25-15-11-23(12-16-25)29(41)35-26-4-3-17-38(2)18-26/h3-18H,1-2H3,(H6-,31,32,33,34,35,36,37,39,40,41)/p+1