(2R)-N-(4-piperidin-1-ylphenyl)-2-(5,6,7,8-tetrahydroisoquinolin-2-ium-2-yl)propanamide

Systemtic Name: (2R)-N-(4-piperidin-1-ylphenyl)-2-(5,6,7,8-tetrahydroisoquinolin-2-ium-2-yl)propanamide Openeye Name: (2R)-N-[4-(1-piperidyl)phenyl]-2-(5,6,7,8-tetrahydroisoquinolin-2-ium-2-yl)propanamide CAS Name: (2R)-N-[4-(1-piperidinyl)phenyl]-2-(5,6,7,8-tetrahydroisoquinolin-2-ium-2-yl)propanamide IUPAC Name: (2R)-N-(4-piperidin-1-ylphenyl)-2-(5,6,7,8-tetrahydroisoquinolin-2-ium-2-yl)propanamide Traditional Name: (2R)-N-(4-piperidinophenyl)-2-(5,6,7,8-tetrahydroisoquinolin-2-ium-2-yl)propionamide Formula: C23H30N3O+ MolecularWeight: 364.5038

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)N2CCCCC2)[N+]3=CC4=C(CCCC4)C=C3

Isomeric SMILES

C[C@H](C(=O)NC1=CC=C(C=C1)N2CCCCC2)[N+]3=CC4=C(CCCC4)C=C3

InChI

InChI=1S/C23H29N3O/c1-18(26-16-13-19-7-3-4-8-20(19)17-26)23(27)24-21-9-11-22(12-10-21)25-14-5-2-6-15-25/h9-13,16-18H,2-8,14-15H2,1H3/p+1/t18-/m1/s1