N-(4-chlorophenyl)-2-[2-[(3S)-3-methylpiperidin-1-ium-1-yl]ethanoylamino]benzamide

Systemtic Name: N-(4-chlorophenyl)-2-[2-[(3S)-3-methylpiperidin-1-ium-1-yl]ethanoylamino]benzamide Openeye Name: N-(4-chlorophenyl)-2-[[2-[(3S)-3-methylpiperidin-1-ium-1-yl]acetyl]amino]benzamide CAS Name: N-(4-chlorophenyl)-2-[[2-[(3S)-3-methyl-1-piperidin-1-iumyl]-1-oxoethyl]amino]benzamide IUPAC Name: N-(4-chlorophenyl)-2-[[2-[(3S)-3-methylpiperidin-1-ium-1-yl]acetyl]amino]benzamide Traditional Name: N-(4-chlorophenyl)-2-[[2-[(3S)-3-methylpiperidin-1-ium-1-yl]acetyl]amino]benzamide Formula: C21H25ClN3O2+ MolecularWeight: 386.8951

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCC[NH+](C1)CC(=O)NC2=CC=CC=C2C(=O)NC3=CC=C(C=C3)Cl

Isomeric SMILES

C[C@H]1CCC[NH+](C1)CC(=O)NC2=CC=CC=C2C(=O)NC3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H24ClN3O2/c1-15-5-4-12-25(13-15)14-20(26)24-19-7-3-2-6-18(19)21(27)23-17-10-8-16(22)9-11-17/h2-3,6-11,15H,4-5,12-14H2,1H3,(H,23,27)(H,24,26)/p+1/t15-/m0/s1