N-[(2R)-2-(furan-2-yl)-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)ethyl]-3,3-dimethyl-butanamide

Systemtic Name: N-[(2R)-2-(furan-2-yl)-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)ethyl]-3,3-dimethyl-butanamide Openeye Name: N-[(2R)-2-(2-furyl)-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)ethyl]-3,3-dimethyl-butanamide CAS Name: N-[(2R)-2-(2-furanyl)-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)ethyl]-3,3-dimethylbutanamide IUPAC Name: N-[(2R)-2-(furan-2-yl)-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)ethyl]-3,3-dimethylbutanamide Traditional Name: N-[(2R)-2-(2-furyl)-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)ethyl]-3,3-dimethyl-butyramide Formula: C21H29N2O2+ MolecularWeight: 341.46716

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(=O)NCC(C1=CC=CO1)[NH+]2CCC3=CC=CC=C3C2

Isomeric SMILES

CC(C)(C)CC(=O)NC[C@H](C1=CC=CO1)[NH+]2CCC3=CC=CC=C3C2

InChI

InChI=1S/C21H28N2O2/c1-21(2,3)13-20(24)22-14-18(19-9-6-12-25-19)23-11-10-16-7-4-5-8-17(16)15-23/h4-9,12,18H,10-11,13-15H2,1-3H3,(H,22,24)/p+1/t18-/m1/s1