2-chloranyl-N-[(1S)-3-[(2-methyl-2-piperidin-1-ium-1-yl-propyl)amino]-3-oxidanylidene-1-phenyl-propyl]benzamide

Systemtic Name: 2-chloranyl-N-[(1S)-3-[(2-methyl-2-piperidin-1-ium-1-yl-propyl)amino]-3-oxidanylidene-1-phenyl-propyl]benzamide Openeye Name: 2-chloro-N-[(1S)-3-[(2-methyl-2-piperidin-1-ium-1-yl-propyl)amino]-3-oxo-1-phenyl-propyl]benzamide CAS Name: 2-chloro-N-[(1S)-3-[[2-methyl-2-(1-piperidin-1-iumyl)propyl]amino]-3-oxo-1-phenylpropyl]benzamide IUPAC Name: 2-chloro-N-[(1S)-3-[(2-methyl-2-piperidin-1-ium-1-ylpropyl)amino]-3-oxo-1-phenylpropyl]benzamide Traditional Name: 2-chloro-N-[(1S)-3-keto-3-[(2-methyl-2-piperidin-1-ium-1-yl-propyl)amino]-1-phenyl-propyl]benzamide Formula: C25H33ClN3O2+ MolecularWeight: 443.00142

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CNC(=O)CC(C1=CC=CC=C1)NC(=O)C2=CC=CC=C2Cl)[NH+]3CCCCC3

Isomeric SMILES

CC(C)(CNC(=O)C[C@@H](C1=CC=CC=C1)NC(=O)C2=CC=CC=C2Cl)[NH+]3CCCCC3

InChI

InChI=1S/C25H32ClN3O2/c1-25(2,29-15-9-4-10-16-29)18-27-23(30)17-22(19-11-5-3-6-12-19)28-24(31)20-13-7-8-14-21(20)26/h3,5-8,11-14,22H,4,9-10,15-18H2,1-2H3,(H,27,30)(H,28,31)/p+1/t22-/m0/s1