2-methyl-N-[(3S)-1-(phenylmethyl)piperidin-1-ium-3-yl]benzamide

Systemtic Name: 2-methyl-N-[(3S)-1-(phenylmethyl)piperidin-1-ium-3-yl]benzamide Openeye Name: N-[(3S)-1-benzylpiperidin-1-ium-3-yl]-2-methyl-benzamide CAS Name: 2-methyl-N-[(3S)-1-(phenylmethyl)-3-piperidin-1-iumyl]benzamide IUPAC Name: N-[(3S)-1-benzylpiperidin-1-ium-3-yl]-2-methylbenzamide Traditional Name: N-[(3S)-1-benzylpiperidin-1-ium-3-yl]-2-methyl-benzamide Formula: C20H25N2O+ MolecularWeight: 309.4253

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)NC2CCC[NH+](C2)CC3=CC=CC=C3

Isomeric SMILES

CC1=CC=CC=C1C(=O)N[C@H]2CCC[NH+](C2)CC3=CC=CC=C3

InChI

InChI=1S/C20H24N2O/c1-16-8-5-6-12-19(16)20(23)21-18-11-7-13-22(15-18)14-17-9-3-2-4-10-17/h2-6,8-10,12,18H,7,11,13-15H2,1H3,(H,21,23)/p+1/t18-/m0/s1