N-(3,3-dimethyl-1,2-dihydroindol-6-yl)-2-[(1-oxidanidylpyridin-1-ium-4-yl)methylamino]pyridine-3-carboxamide

Systemtic Name: N-(3,3-dimethyl-1,2-dihydroindol-6-yl)-2-[(1-oxidanidylpyridin-1-ium-4-yl)methylamino]pyridine-3-carboxamide Openeye Name: N-(3,3-dimethylindolin-6-yl)-2-[(1-oxidopyridin-1-ium-4-yl)methylamino]pyridine-3-carboxamide CAS Name: N-(3,3-dimethyl-1,2-dihydroindol-6-yl)-2-[(1-oxido-4-pyridin-1-iumyl)methylamino]-3-pyridinecarboxamide IUPAC Name: N-(3,3-dimethyl-1,2-dihydroindol-6-yl)-2-[(1-oxidopyridin-1-ium-4-yl)methylamino]pyridine-3-carboxamide Traditional Name: N-(3,3-dimethylindolin-6-yl)-2-[(1-oxidopyridin-1-ium-4-yl)methylamino]nicotinamide Formula: C22H23N5O2 MolecularWeight: 389.45032

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CNC2=C1C=CC(=C2)NC(=O)C3=C(N=CC=C3)NCC4=CC=[N+](C=C4)[O-])C

Isomeric SMILES

CC1(CNC2=C1C=CC(=C2)NC(=O)C3=C(N=CC=C3)NCC4=CC=[N+](C=C4)[O-])C

InChI

InChI=1S/C22H23N5O2/c1-22(2)14-25-19-12-16(5-6-18(19)22)26-21(28)17-4-3-9-23-20(17)24-13-15-7-10-27(29)11-8-15/h3-12,25H,13-14H2,1-2H3,(H,23,24)(H,26,28)