3-[(3R)-1-[(5-ethanoylthiophen-3-yl)methyl]piperidin-1-ium-3-yl]-N-[(5-methylfuran-2-yl)methyl]propanamide

Systemtic Name: 3-[(3R)-1-[(5-ethanoylthiophen-3-yl)methyl]piperidin-1-ium-3-yl]-N-[(5-methylfuran-2-yl)methyl]propanamide Openeye Name: 3-[(3R)-1-[(5-acetyl-3-thienyl)methyl]piperidin-1-ium-3-yl]-N-[(5-methyl-2-furyl)methyl]propanamide CAS Name: 3-[(3R)-1-[(5-acetyl-3-thiophenyl)methyl]-3-piperidin-1-iumyl]-N-[(5-methyl-2-furanyl)methyl]propanamide IUPAC Name: 3-[(3R)-1-[(5-acetylthiophen-3-yl)methyl]piperidin-1-ium-3-yl]-N-[(5-methylfuran-2-yl)methyl]propanamide Traditional Name: 3-[(3R)-1-[(5-acetyl-3-thienyl)methyl]piperidin-1-ium-3-yl]-N-[(5-methyl-2-furyl)methyl]propionamide Formula: C21H29N2O3S+ MolecularWeight: 389.53156

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)CNC(=O)CCC2CCC[NH+](C2)CC3=CSC(=C3)C(=O)C

Isomeric SMILES

CC1=CC=C(O1)CNC(=O)CC[C@H]2CCC[NH+](C2)CC3=CSC(=C3)C(=O)C

InChI

InChI=1S/C21H28N2O3S/c1-15-5-7-19(26-15)11-22-21(25)8-6-17-4-3-9-23(12-17)13-18-10-20(16(2)24)27-14-18/h5,7,10,14,17H,3-4,6,8-9,11-13H2,1-2H3,(H,22,25)/p+1/t17-/m1/s1