[[3,5-bis(chloranyl)phenyl]-(1-methylimidazol-2-yl)-propyl-azaniumyl]methanoate

Systemtic Name: [[3,5-bis(chloranyl)phenyl]-(1-methylimidazol-2-yl)-propyl-azaniumyl]methanoate Openeye Name: [(3,5-dichlorophenyl)-(1-methylimidazol-2-yl)-propyl-ammonio]formate CAS Name: [(3,5-dichlorophenyl)-(1-methyl-2-imidazolyl)-propylammonio]formate IUPAC Name: [(3,5-dichlorophenyl)-(1-methylimidazol-2-yl)-propylazaniumyl]formate Traditional Name: [(3,5-dichlorophenyl)-(1-methylimidazol-2-yl)-propyl-ammonio]formate Formula: C14H15Cl2N3O2 MolecularWeight: 328.1938

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Descriptors Computed from Structure

Canonical SMILES:

CCC[N+](C1=CC(=CC(=C1)Cl)Cl)(C2=NC=CN2C)C(=O)[O-]

Isomeric SMILES

CCC[N+](C1=CC(=CC(=C1)Cl)Cl)(C2=NC=CN2C)C(=O)[O-]

InChI

InChI=1S/C14H15Cl2N3O2/c1-3-6-19(14(20)21,13-17-4-5-18(13)2)12-8-10(15)7-11(16)9-12/h4-5,7-9H,3,6H2,1-2H3