N1,N3-bis[4-[(1-methylpyridin-1-ium-4-yl)carbamoyl]phenyl]benzene-1,3-dicarboxamide

Systemtic Name: N1,N3-bis[4-[(1-methylpyridin-1-ium-4-yl)carbamoyl]phenyl]benzene-1,3-dicarboxamide Openeye Name: N1,N3-bis[4-[(1-methylpyridin-1-ium-4-yl)carbamoyl]phenyl]benzene-1,3-dicarboxamide CAS Name: N1,N3-bis[4-[[(1-methyl-4-pyridin-1-iumyl)amino]-oxomethyl]phenyl]benzene-1,3-dicarboxamide IUPAC Name: 1-N,3-N-bis[4-[(1-methylpyridin-1-ium-4-yl)carbamoyl]phenyl]benzene-1,3-dicarboxamide Traditional Name: N,N'-bis[4-[(1-methylpyridin-1-ium-4-yl)carbamoyl]phenyl]isophthalamide Formula: C34H30N6O4+2 MolecularWeight: 586.6398

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)NC(=O)C3=CC(=CC=C3)C(=O)NC4=CC=C(C=C4)C(=O)NC5=CC=[N+](C=C5)C

Isomeric SMILES

C[N+]1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)NC(=O)C3=CC(=CC=C3)C(=O)NC4=CC=C(C=C4)C(=O)NC5=CC=[N+](C=C5)C

InChI

InChI=1S/C34H28N6O4/c1-39-18-14-29(15-19-39)37-31(41)23-6-10-27(11-7-23)35-33(43)25-4-3-5-26(22-25)34(44)36-28-12-8-24(9-13-28)32(42)38-30-16-20-40(2)21-17-30/h3-22H,1-2H3,(H2,35,36,41,42,43,44)/p+2