N-(2-aminocarbonylphenyl)-2-pyrrolidin-1-yl-pyridin-1-ium-3-carboxamide

Systemtic Name: N-(2-aminocarbonylphenyl)-2-pyrrolidin-1-yl-pyridin-1-ium-3-carboxamide Openeye Name: N-(2-carbamoylphenyl)-2-pyrrolidin-1-yl-pyridin-1-ium-3-carboxamide CAS Name: N-(2-carbamoylphenyl)-2-(1-pyrrolidinyl)-3-pyridin-1-iumcarboxamide IUPAC Name: N-(2-carbamoylphenyl)-2-pyrrolidin-1-ylpyridin-1-ium-3-carboxamide Traditional Name: N-(2-carbamoylphenyl)-2-pyrrolidino-pyridin-1-ium-3-carboxamide Formula: C17H19N4O2+ MolecularWeight: 311.35836

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C=CC=[NH+]2)C(=O)NC3=CC=CC=C3C(=O)N

Isomeric SMILES

C1CCN(C1)C2=C(C=CC=[NH+]2)C(=O)NC3=CC=CC=C3C(=O)N

InChI

InChI=1S/C17H18N4O2/c18-15(22)12-6-1-2-8-14(12)20-17(23)13-7-5-9-19-16(13)21-10-3-4-11-21/h1-2,5-9H,3-4,10-11H2,(H2,18,22)(H,20,23)/p+1