N-[(2R)-1-methoxypropan-2-yl]-4-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)benzamide

Systemtic Name: N-[(2R)-1-methoxypropan-2-yl]-4-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)benzamide Openeye Name: N-[(1R)-2-methoxy-1-methyl-ethyl]-4-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)benzamide CAS Name: N-[(2R)-1-methoxypropan-2-yl]-4-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)benzamide IUPAC Name: N-[(2R)-1-methoxypropan-2-yl]-4-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)benzamide Traditional Name: N-[(1R)-2-methoxy-1-methyl-ethyl]-4-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)benzamide Formula: C21H27N2O2+ MolecularWeight: 339.45128

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Descriptors Computed from Structure

Canonical SMILES:

CC(COC)NC(=O)C1=CC=C(C=C1)C[NH+]2CCC3=CC=CC=C3C2

Isomeric SMILES

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

InChI

InChI=1S/C21H26N2O2/c1-16(15-25-2)22-21(24)19-9-7-17(8-10-19)13-23-12-11-18-5-3-4-6-20(18)14-23/h3-10,16H,11-15H2,1-2H3,(H,22,24)/p+1/t16-/m1/s1