1-methyl-N-[(E)-phenethylideneamino]pyridin-1-ium-3-carboxamide

Systemtic Name: 1-methyl-N-[(E)-phenethylideneamino]pyridin-1-ium-3-carboxamide Openeye Name: 1-methyl-N-[(E)-phenethylideneamino]pyridin-1-ium-3-carboxamide CAS Name: 1-methyl-N-[(E)-phenethylideneamino]-3-pyridin-1-iumcarboxamide IUPAC Name: 1-methyl-N-[(E)-phenethylideneamino]pyridin-1-ium-3-carboxamide Traditional Name: 1-methyl-N-[(E)-phenethylideneamino]pyridin-1-ium-3-carboxamide Formula: C15H16N3O+ MolecularWeight: 254.30704

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CC=CC(=C1)C(=O)NN=CCC2=CC=CC=C2

Isomeric SMILES

C[N+]1=CC=CC(=C1)C(=O)N/N=C/CC2=CC=CC=C2

InChI

InChI=1S/C15H15N3O/c1-18-11-5-8-14(12-18)15(19)17-16-10-9-13-6-3-2-4-7-13/h2-8,10-12H,9H2,1H3/p+1/b16-10+