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

Systemtic Name: 4-methyl-N-[(3S)-1-(phenylmethyl)piperidin-1-ium-3-yl]benzamide Openeye Name: N-[(3S)-1-benzylpiperidin-1-ium-3-yl]-4-methyl-benzamide CAS Name: 4-methyl-N-[(3S)-1-(phenylmethyl)-3-piperidin-1-iumyl]benzamide IUPAC Name: N-[(3S)-1-benzylpiperidin-1-ium-3-yl]-4-methylbenzamide Traditional Name: N-[(3S)-1-benzylpiperidin-1-ium-3-yl]-4-methyl-benzamide Formula: C20H25N2O+ MolecularWeight: 309.4253

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NC2CCC[NH+](C2)CC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N[C@H]2CCC[NH+](C2)CC3=CC=CC=C3

InChI

InChI=1S/C20H24N2O/c1-16-9-11-18(12-10-16)20(23)21-19-8-5-13-22(15-19)14-17-6-3-2-4-7-17/h2-4,6-7,9-12,19H,5,8,13-15H2,1H3,(H,21,23)/p+1/t19-/m0/s1