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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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