N-[(2,4-dichlorophenyl)methyl]-2-pyrrolidin-1-yl-pyridin-1-ium-3-carboxamide

Systemtic Name: N-[(2,4-dichlorophenyl)methyl]-2-pyrrolidin-1-yl-pyridin-1-ium-3-carboxamide Openeye Name: N-[(2,4-dichlorophenyl)methyl]-2-pyrrolidin-1-yl-pyridin-1-ium-3-carboxamide CAS Name: N-[(2,4-dichlorophenyl)methyl]-2-(1-pyrrolidinyl)-3-pyridin-1-iumcarboxamide IUPAC Name: N-[(2,4-dichlorophenyl)methyl]-2-pyrrolidin-1-ylpyridin-1-ium-3-carboxamide Traditional Name: N-(2,4-dichlorobenzyl)-2-pyrrolidino-pyridin-1-ium-3-carboxamide Formula: C17H18Cl2N3O+ MolecularWeight: 351.25032

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C=CC=[NH+]2)C(=O)NCC3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

C1CCN(C1)C2=C(C=CC=[NH+]2)C(=O)NCC3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C17H17Cl2N3O/c18-13-6-5-12(15(19)10-13)11-21-17(23)14-4-3-7-20-16(14)22-8-1-2-9-22/h3-7,10H,1-2,8-9,11H2,(H,21,23)/p+1