N2,N5-bis(1-butylquinolin-1-ium-7-yl)pyridine-2,5-dicarboxamide

Systemtic Name: N2,N5-bis(1-butylquinolin-1-ium-7-yl)pyridine-2,5-dicarboxamide Openeye Name: N2,N5-bis(1-butylquinolin-1-ium-7-yl)pyridine-2,5-dicarboxamide CAS Name: N2,N5-bis(1-butyl-7-quinolin-1-iumyl)pyridine-2,5-dicarboxamide IUPAC Name: 2-N,5-N-bis(1-butylquinolin-1-ium-7-yl)pyridine-2,5-dicarboxamide Traditional Name: N,N'-bis(1-butylquinolin-1-ium-7-yl)isocinchomeronamide Formula: C33H35N5O2+2 MolecularWeight: 533.6633

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[N+]1=CC=CC2=C1C=C(C=C2)NC(=O)C3=CN=C(C=C3)C(=O)NC4=CC5=C(C=CC=[N+]5CCCC)C=C4

Isomeric SMILES

CCCC[N+]1=CC=CC2=C1C=C(C=C2)NC(=O)C3=CN=C(C=C3)C(=O)NC4=CC5=C(C=CC=[N+]5CCCC)C=C4

InChI

InChI=1S/C33H33N5O2/c1-3-5-17-37-19-7-9-24-11-14-27(21-30(24)37)35-32(39)26-13-16-29(34-23-26)33(40)36-28-15-12-25-10-8-20-38(18-6-4-2)31(25)22-28/h7-16,19-23H,3-6,17-18H2,1-2H3/p+2