N-[3,3-dimethyl-1-[(1-oxidanidylpyridin-1-ium-4-yl)methyl]-2H-indol-6-yl]-2-(pyridin-4-ylmethylamino)pyridine-3-carboxamide

Systemtic Name: N-[3,3-dimethyl-1-[(1-oxidanidylpyridin-1-ium-4-yl)methyl]-2H-indol-6-yl]-2-(pyridin-4-ylmethylamino)pyridine-3-carboxamide Openeye Name: N-[3,3-dimethyl-1-[(1-oxidopyridin-1-ium-4-yl)methyl]indolin-6-yl]-2-(4-pyridylmethylamino)pyridine-3-carboxamide CAS Name: N-[3,3-dimethyl-1-[(1-oxido-4-pyridin-1-iumyl)methyl]-2H-indol-6-yl]-2-(pyridin-4-ylmethylamino)-3-pyridinecarboxamide IUPAC Name: N-[3,3-dimethyl-1-[(1-oxidopyridin-1-ium-4-yl)methyl]-2H-indol-6-yl]-2-(pyridin-4-ylmethylamino)pyridine-3-carboxamide Traditional Name: N-[3,3-dimethyl-1-[(1-oxidopyridin-1-ium-4-yl)methyl]indolin-6-yl]-2-(4-pyridylmethylamino)nicotinamide Formula: C28H28N6O2 MolecularWeight: 480.56092

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CN(C2=C1C=CC(=C2)NC(=O)C3=C(N=CC=C3)NCC4=CC=NC=C4)CC5=CC=[N+](C=C5)[O-])C

Isomeric SMILES

CC1(CN(C2=C1C=CC(=C2)NC(=O)C3=C(N=CC=C3)NCC4=CC=NC=C4)CC5=CC=[N+](C=C5)[O-])C

InChI

InChI=1S/C28H28N6O2/c1-28(2)19-33(18-21-9-14-34(36)15-10-21)25-16-22(5-6-24(25)28)32-27(35)23-4-3-11-30-26(23)31-17-20-7-12-29-13-8-20/h3-16H,17-19H2,1-2H3,(H,30,31)(H,32,35)