4-methyl-N-[(2S)-2-(5-methylfuran-2-yl)-2-piperidin-1-ium-1-yl-ethyl]benzamide

Systemtic Name: 4-methyl-N-[(2S)-2-(5-methylfuran-2-yl)-2-piperidin-1-ium-1-yl-ethyl]benzamide Openeye Name: 4-methyl-N-[(2S)-2-(5-methyl-2-furyl)-2-piperidin-1-ium-1-yl-ethyl]benzamide CAS Name: 4-methyl-N-[(2S)-2-(5-methyl-2-furanyl)-2-(1-piperidin-1-iumyl)ethyl]benzamide IUPAC Name: 4-methyl-N-[(2S)-2-(5-methylfuran-2-yl)-2-piperidin-1-ium-1-ylethyl]benzamide Traditional Name: 4-methyl-N-[(2S)-2-(5-methyl-2-furyl)-2-piperidin-1-ium-1-yl-ethyl]benzamide Formula: C20H27N2O2+ MolecularWeight: 327.44058

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NCC(C2=CC=C(O2)C)[NH+]3CCCCC3

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NC[C@@H](C2=CC=C(O2)C)[NH+]3CCCCC3

InChI

InChI=1S/C20H26N2O2/c1-15-6-9-17(10-7-15)20(23)21-14-18(19-11-8-16(2)24-19)22-12-4-3-5-13-22/h6-11,18H,3-5,12-14H2,1-2H3,(H,21,23)/p+1/t18-/m0/s1