N,N-bis(2-chloroethyl)-2-pyrrolidin-3-yl-pyridin-1-ium-1-carboxamide chloride

Systemtic Name: N,N-bis(2-chloroethyl)-2-pyrrolidin-3-yl-pyridin-1-ium-1-carboxamide chloride Openeye Name: N,N-bis(2-chloroethyl)-2-pyrrolidin-3-yl-pyridin-1-ium-1-carboxamide chloride CAS Name: N,N-bis(2-chloroethyl)-2-(3-pyrrolidinyl)-1-pyridin-1-iumcarboxamide chloride IUPAC Name: N,N-bis(2-chloroethyl)-2-pyrrolidin-3-ylpyridin-1-ium-1-carboxamide chloride Traditional Name: N,N-bis(2-chloroethyl)-2-pyrrolidin-3-yl-pyridin-1-ium-1-carboxamide chloride Formula: C14H20Cl3N3O MolecularWeight: 352.6871

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCC1C2=CC=CC=[N+]2C(=O)N(CCCl)CCCl.[Cl-]

Isomeric SMILES

C1CNCC1C2=CC=CC=[N+]2C(=O)N(CCCl)CCCl.[Cl-]

InChI

InChI=1S/C14H20Cl2N3O.ClH/c15-5-9-18(10-6-16)14(20)19-8-2-1-3-13(19)12-4-7-17-11-12;/h1-3,8,12,17H,4-7,9-11H2;1H/q+1;/p-1