1-[(3-cyanophenyl)methyl]-4-methyl-N-[(1-oxidanidylpyridin-1-ium-4-yl)methyl]indole-2-carboxamide

Systemtic Name: 1-[(3-cyanophenyl)methyl]-4-methyl-N-[(1-oxidanidylpyridin-1-ium-4-yl)methyl]indole-2-carboxamide Openeye Name: 1-[(3-cyanophenyl)methyl]-4-methyl-N-[(1-oxidopyridin-1-ium-4-yl)methyl]indole-2-carboxamide CAS Name: 1-[(3-cyanophenyl)methyl]-4-methyl-N-[(1-oxido-4-pyridin-1-iumyl)methyl]-2-indolecarboxamide IUPAC Name: 1-[(3-cyanophenyl)methyl]-4-methyl-N-[(1-oxidopyridin-1-ium-4-yl)methyl]indole-2-carboxamide Traditional Name: 1-(3-cyanobenzyl)-4-methyl-N-[(1-oxidopyridin-1-ium-4-yl)methyl]indole-2-carboxamide Formula: C24H20N4O2 MolecularWeight: 396.4412

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C=C(N(C2=CC=C1)CC3=CC=CC(=C3)C#N)C(=O)NCC4=CC=[N+](C=C4)[O-]

Isomeric SMILES

CC1=C2C=C(N(C2=CC=C1)CC3=CC=CC(=C3)C#N)C(=O)NCC4=CC=[N+](C=C4)[O-]

InChI

InChI=1S/C24H20N4O2/c1-17-4-2-7-22-21(17)13-23(24(29)26-15-18-8-10-27(30)11-9-18)28(22)16-20-6-3-5-19(12-20)14-25/h2-13H,15-16H2,1H3,(H,26,29)