1-[2,3-bis[(3-aminocarbonylpyridin-1-ium-1-yl)methoxy]propoxymethyl]pyridin-1-ium-3-carboxamide

Systemtic Name: 1-[2,3-bis[(3-aminocarbonylpyridin-1-ium-1-yl)methoxy]propoxymethyl]pyridin-1-ium-3-carboxamide Openeye Name: 1-[2,3-bis[(3-carbamoylpyridin-1-ium-1-yl)methoxy]propoxymethyl]pyridin-1-ium-3-carboxamide CAS Name: 1-[2,3-bis[(3-carbamoyl-1-pyridin-1-iumyl)methoxy]propoxymethyl]-3-pyridin-1-iumcarboxamide IUPAC Name: 1-[2,3-bis[(3-carbamoylpyridin-1-ium-1-yl)methoxy]propoxymethyl]pyridin-1-ium-3-carboxamide Traditional Name: 1-[2,3-bis[(3-carbamoylpyridin-1-ium-1-yl)methoxy]propoxymethyl]pyridin-1-ium-3-carboxamide Formula: C24H29N6O6+3 MolecularWeight: 497.52366

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C[N+](=C1)COCC(COC[N+]2=CC=CC(=C2)C(=O)N)OC[N+]3=CC=CC(=C3)C(=O)N)C(=O)N

Isomeric SMILES

C1=CC(=C[N+](=C1)COCC(COC[N+]2=CC=CC(=C2)C(=O)N)OC[N+]3=CC=CC(=C3)C(=O)N)C(=O)N

InChI

InChI=1S/C24H26N6O6/c25-22(31)18-4-1-7-28(10-18)15-34-13-21(36-17-30-9-3-6-20(12-30)24(27)33)14-35-16-29-8-2-5-19(11-29)23(26)32/h1-12,21H,13-17H2,(H3-3,25,26,27,31,32,33)/p+3