2-[(3S)-3-methylpiperidin-1-yl]-N-(phenylmethyl)pyridin-1-ium-3-carboxamide

Systemtic Name: 2-[(3S)-3-methylpiperidin-1-yl]-N-(phenylmethyl)pyridin-1-ium-3-carboxamide Openeye Name: N-benzyl-2-[(3S)-3-methyl-1-piperidyl]pyridin-1-ium-3-carboxamide CAS Name: 2-[(3S)-3-methyl-1-piperidinyl]-N-(phenylmethyl)-3-pyridin-1-iumcarboxamide IUPAC Name: N-benzyl-2-[(3S)-3-methylpiperidin-1-yl]pyridin-1-ium-3-carboxamide Traditional Name: N-benzyl-2-[(3S)-3-methylpiperidino]pyridin-1-ium-3-carboxamide Formula: C19H24N3O+ MolecularWeight: 310.41336

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C2=C(C=CC=[NH+]2)C(=O)NCC3=CC=CC=C3

Isomeric SMILES

C[C@H]1CCCN(C1)C2=C(C=CC=[NH+]2)C(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C19H23N3O/c1-15-7-6-12-22(14-15)18-17(10-5-11-20-18)19(23)21-13-16-8-3-2-4-9-16/h2-5,8-11,15H,6-7,12-14H2,1H3,(H,21,23)/p+1/t15-/m0/s1