4-methyl-N-[(1R)-2-oxidanylidene-2-phenyl-1-piperidin-1-ium-1-yl-ethyl]benzamide

Systemtic Name: 4-methyl-N-[(1R)-2-oxidanylidene-2-phenyl-1-piperidin-1-ium-1-yl-ethyl]benzamide Openeye Name: 4-methyl-N-[(1R)-2-oxo-2-phenyl-1-piperidin-1-ium-1-yl-ethyl]benzamide CAS Name: 4-methyl-N-[(1R)-2-oxo-2-phenyl-1-(1-piperidin-1-iumyl)ethyl]benzamide IUPAC Name: 4-methyl-N-[(1R)-2-oxo-2-phenyl-1-piperidin-1-ium-1-ylethyl]benzamide Traditional Name: N-[(1R)-2-keto-2-phenyl-1-piperidin-1-ium-1-yl-ethyl]-4-methyl-benzamide Formula: C21H25N2O2+ MolecularWeight: 337.4354

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NC(C(=O)C2=CC=CC=C2)[NH+]3CCCCC3

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N[C@@H](C(=O)C2=CC=CC=C2)[NH+]3CCCCC3

InChI

InChI=1S/C21H24N2O2/c1-16-10-12-18(13-11-16)21(25)22-20(23-14-6-3-7-15-23)19(24)17-8-4-2-5-9-17/h2,4-5,8-13,20H,3,6-7,14-15H2,1H3,(H,22,25)/p+1/t20-/m1/s1