(3R)-N-[(2R)-2-(furan-2-yl)-2-piperidin-1-ium-1-yl-ethyl]-3-phenyl-butanamide

Systemtic Name: (3R)-N-[(2R)-2-(furan-2-yl)-2-piperidin-1-ium-1-yl-ethyl]-3-phenyl-butanamide Openeye Name: (3R)-N-[(2R)-2-(2-furyl)-2-piperidin-1-ium-1-yl-ethyl]-3-phenyl-butanamide CAS Name: (3R)-N-[(2R)-2-(2-furanyl)-2-(1-piperidin-1-iumyl)ethyl]-3-phenylbutanamide IUPAC Name: (3R)-N-[(2R)-2-(furan-2-yl)-2-piperidin-1-ium-1-ylethyl]-3-phenylbutanamide Traditional Name: (3R)-N-[(2R)-2-(2-furyl)-2-piperidin-1-ium-1-yl-ethyl]-3-phenyl-butyramide Formula: C21H29N2O2+ MolecularWeight: 341.46716

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)NCC(C1=CC=CO1)[NH+]2CCCCC2)C3=CC=CC=C3

Isomeric SMILES

C[C@H](CC(=O)NC[C@H](C1=CC=CO1)[NH+]2CCCCC2)C3=CC=CC=C3

InChI

InChI=1S/C21H28N2O2/c1-17(18-9-4-2-5-10-18)15-21(24)22-16-19(20-11-8-14-25-20)23-12-6-3-7-13-23/h2,4-5,8-11,14,17,19H,3,6-7,12-13,15-16H2,1H3,(H,22,24)/p+1/t17-,19-/m1/s1