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

Systemtic Name: 4-methyl-N-[(3S)-piperidin-1-ium-3-yl]benzamide Openeye Name: 4-methyl-N-[(3S)-piperidin-1-ium-3-yl]benzamide CAS Name: 4-methyl-N-[(3S)-3-piperidin-1-iumyl]benzamide IUPAC Name: 4-methyl-N-[(3S)-piperidin-1-ium-3-yl]benzamide Traditional Name: 4-methyl-N-[(3S)-piperidin-1-ium-3-yl]benzamide Formula: C13H19N2O+ MolecularWeight: 219.30276

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NC2CCC[NH2+]C2

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N[C@H]2CCC[NH2+]C2

InChI

InChI=1S/C13H18N2O/c1-10-4-6-11(7-5-10)13(16)15-12-3-2-8-14-9-12/h4-7,12,14H,2-3,8-9H2,1H3,(H,15,16)/p+1/t12-/m0/s1