N-[2-(3-cyano-1H-indol-5-yl)ethyl]-4-(1-oxidanidylpyridin-1-ium-4-yl)benzamide

Systemtic Name: N-[2-(3-cyano-1H-indol-5-yl)ethyl]-4-(1-oxidanidylpyridin-1-ium-4-yl)benzamide Openeye Name: N-[2-(3-cyano-1H-indol-5-yl)ethyl]-4-(1-oxidopyridin-1-ium-4-yl)benzamide CAS Name: N-[2-(3-cyano-1H-indol-5-yl)ethyl]-4-(1-oxido-4-pyridin-1-iumyl)benzamide IUPAC Name: N-[2-(3-cyano-1H-indol-5-yl)ethyl]-4-(1-oxidopyridin-1-ium-4-yl)benzamide Traditional Name: N-[2-(3-cyano-1H-indol-5-yl)ethyl]-4-(1-oxidopyridin-1-ium-4-yl)benzamide Formula: C23H18N4O2 MolecularWeight: 382.41462

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=CC=[N+](C=C2)[O-])C(=O)NCCC3=CC4=C(C=C3)NC=C4C#N

Isomeric SMILES

C1=CC(=CC=C1C2=CC=[N+](C=C2)[O-])C(=O)NCCC3=CC4=C(C=C3)NC=C4C#N

InChI

InChI=1S/C23H18N4O2/c24-14-20-15-26-22-6-1-16(13-21(20)22)7-10-25-23(28)19-4-2-17(3-5-19)18-8-11-27(29)12-9-18/h1-6,8-9,11-13,15,26H,7,10H2,(H,25,28)