3,4-dimethyl-N-[2-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propylamino]-2-oxidanylidene-ethyl]benzamide

Systemtic Name: 3,4-dimethyl-N-[2-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propylamino]-2-oxidanylidene-ethyl]benzamide Openeye Name: 3,4-dimethyl-N-[2-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propylamino]-2-oxo-ethyl]benzamide CAS Name: 3,4-dimethyl-N-[2-[3-[(2S)-2-methyl-1-piperidin-1-iumyl]propylamino]-2-oxoethyl]benzamide IUPAC Name: 3,4-dimethyl-N-[2-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propylamino]-2-oxoethyl]benzamide Traditional Name: N-[2-keto-2-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propylamino]ethyl]-3,4-dimethyl-benzamide Formula: C20H32N3O2+ MolecularWeight: 346.48698

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC[NH+]1CCCNC(=O)CNC(=O)C2=CC(=C(C=C2)C)C

Isomeric SMILES

C[C@H]1CCCC[NH+]1CCCNC(=O)CNC(=O)C2=CC(=C(C=C2)C)C

InChI

InChI=1S/C20H31N3O2/c1-15-8-9-18(13-16(15)2)20(25)22-14-19(24)21-10-6-12-23-11-5-4-7-17(23)3/h8-9,13,17H,4-7,10-12,14H2,1-3H3,(H,21,24)(H,22,25)/p+1/t17-/m0/s1