N-cycloheptyl-1-[(3-methylphenyl)methyl]piperidin-1-ium-4-carboxamide

Systemtic Name: N-cycloheptyl-1-[(3-methylphenyl)methyl]piperidin-1-ium-4-carboxamide Openeye Name: N-cycloheptyl-1-(m-tolylmethyl)piperidin-1-ium-4-carboxamide CAS Name: N-cycloheptyl-1-[(3-methylphenyl)methyl]-4-piperidin-1-iumcarboxamide IUPAC Name: N-cycloheptyl-1-[(3-methylphenyl)methyl]piperidin-1-ium-4-carboxamide Traditional Name: N-cycloheptyl-1-(3-methylbenzyl)piperidin-1-ium-4-carboxamide Formula: C21H33N2O+ MolecularWeight: 329.49952

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)C[NH+]2CCC(CC2)C(=O)NC3CCCCCC3

Isomeric SMILES

CC1=CC(=CC=C1)C[NH+]2CCC(CC2)C(=O)NC3CCCCCC3

InChI

InChI=1S/C21H32N2O/c1-17-7-6-8-18(15-17)16-23-13-11-19(12-14-23)21(24)22-20-9-4-2-3-5-10-20/h6-8,15,19-20H,2-5,9-14,16H2,1H3,(H,22,24)/p+1