(2R)-N-(4-phenoxyphenyl)-2-(5,6,7,8-tetrahydroisoquinolin-2-ium-2-yl)propanamide

Systemtic Name: (2R)-N-(4-phenoxyphenyl)-2-(5,6,7,8-tetrahydroisoquinolin-2-ium-2-yl)propanamide Openeye Name: (2R)-N-(4-phenoxyphenyl)-2-(5,6,7,8-tetrahydroisoquinolin-2-ium-2-yl)propanamide CAS Name: (2R)-N-(4-phenoxyphenyl)-2-(5,6,7,8-tetrahydroisoquinolin-2-ium-2-yl)propanamide IUPAC Name: (2R)-N-(4-phenoxyphenyl)-2-(5,6,7,8-tetrahydroisoquinolin-2-ium-2-yl)propanamide Traditional Name: (2R)-N-(4-phenoxyphenyl)-2-(5,6,7,8-tetrahydroisoquinolin-2-ium-2-yl)propionamide Formula: C24H25N2O2+ MolecularWeight: 373.4675

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)OC2=CC=CC=C2)[N+]3=CC4=C(CCCC4)C=C3

Isomeric SMILES

C[C@H](C(=O)NC1=CC=C(C=C1)OC2=CC=CC=C2)[N+]3=CC4=C(CCCC4)C=C3

InChI

InChI=1S/C24H24N2O2/c1-18(26-16-15-19-7-5-6-8-20(19)17-26)24(27)25-21-11-13-23(14-12-21)28-22-9-3-2-4-10-22/h2-4,9-18H,5-8H2,1H3/p+1/t18-/m1/s1