N-butyl-4-chloranyl-N-(8-methyl-8-azoniabicyclo[3.2.1]oct-3-en-3-yl)benzamide chloride

Systemtic Name: N-butyl-4-chloranyl-N-(8-methyl-8-azoniabicyclo[3.2.1]oct-3-en-3-yl)benzamide chloride Openeye Name: N-butyl-4-chloro-N-(8-methyl-8-azoniabicyclo[3.2.1]oct-3-en-3-yl)benzamide chloride CAS Name: N-butyl-4-chloro-N-(8-methyl-8-azoniabicyclo[3.2.1]oct-3-en-3-yl)benzamide chloride IUPAC Name: N-butyl-4-chloro-N-(8-methyl-8-azoniabicyclo[3.2.1]oct-3-en-3-yl)benzamide chloride Traditional Name: N-butyl-4-chloro-N-(8-methyl-8-azoniabicyclo[3.2.1]oct-3-en-3-yl)benzamide chloride Formula: C19H26Cl2N2O MolecularWeight: 369.32854

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C1=CC2CCC(C1)[NH+]2C)C(=O)C3=CC=C(C=C3)Cl.[Cl-]

Isomeric SMILES

CCCCN(C1=CC2CCC(C1)[NH+]2C)C(=O)C3=CC=C(C=C3)Cl.[Cl-]

InChI

InChI=1S/C19H25ClN2O.ClH/c1-3-4-11-22(19(23)14-5-7-15(20)8-6-14)18-12-16-9-10-17(13-18)21(16)2;/h5-8,12,16-17H,3-4,9-11,13H2,1-2H3;1H