2-[2-[(2S)-2-methylpiperidin-1-ium-1-yl]ethanoylamino]-N-(phenylmethyl)benzamide

Systemtic Name: 2-[2-[(2S)-2-methylpiperidin-1-ium-1-yl]ethanoylamino]-N-(phenylmethyl)benzamide Openeye Name: N-benzyl-2-[[2-[(2S)-2-methylpiperidin-1-ium-1-yl]acetyl]amino]benzamide CAS Name: 2-[[2-[(2S)-2-methyl-1-piperidin-1-iumyl]-1-oxoethyl]amino]-N-(phenylmethyl)benzamide IUPAC Name: N-benzyl-2-[[2-[(2S)-2-methylpiperidin-1-ium-1-yl]acetyl]amino]benzamide Traditional Name: N-benzyl-2-[[2-[(2S)-2-methylpiperidin-1-ium-1-yl]acetyl]amino]benzamide Formula: C22H28N3O2+ MolecularWeight: 366.47662

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC[NH+]1CC(=O)NC2=CC=CC=C2C(=O)NCC3=CC=CC=C3

Isomeric SMILES

C[C@H]1CCCC[NH+]1CC(=O)NC2=CC=CC=C2C(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C22H27N3O2/c1-17-9-7-8-14-25(17)16-21(26)24-20-13-6-5-12-19(20)22(27)23-15-18-10-3-2-4-11-18/h2-6,10-13,17H,7-9,14-16H2,1H3,(H,23,27)(H,24,26)/p+1/t17-/m0/s1