N-(4-methoxyphenyl)-2-[(1S)-2,3,3-trimethyl-2,4-dihydro-1H-isoquinolin-2-ium-1-yl]ethanamide

Systemtic Name: N-(4-methoxyphenyl)-2-[(1S)-2,3,3-trimethyl-2,4-dihydro-1H-isoquinolin-2-ium-1-yl]ethanamide Openeye Name: N-(4-methoxyphenyl)-2-[(1S)-2,3,3-trimethyl-2,4-dihydro-1H-isoquinolin-2-ium-1-yl]acetamide CAS Name: N-(4-methoxyphenyl)-2-[(1S)-2,3,3-trimethyl-2,4-dihydro-1H-isoquinolin-2-ium-1-yl]acetamide IUPAC Name: N-(4-methoxyphenyl)-2-[(1S)-2,3,3-trimethyl-2,4-dihydro-1H-isoquinolin-2-ium-1-yl]acetamide Traditional Name: N-(4-methoxyphenyl)-2-[(1S)-2,3,3-trimethyl-2,4-dihydro-1H-isoquinolin-2-ium-1-yl]acetamide Formula: C21H27N2O2+ MolecularWeight: 339.45128

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=CC=CC=C2C([NH+]1C)CC(=O)NC3=CC=C(C=C3)OC)C

Isomeric SMILES

CC1(CC2=CC=CC=C2[C@@H]([NH+]1C)CC(=O)NC3=CC=C(C=C3)OC)C

InChI

InChI=1S/C21H26N2O2/c1-21(2)14-15-7-5-6-8-18(15)19(23(21)3)13-20(24)22-16-9-11-17(25-4)12-10-16/h5-12,19H,13-14H2,1-4H3,(H,22,24)/p+1/t19-/m0/s1