N-[2-[[(1S)-cyclohex-3-en-1-yl]methyl]-1,2,3,4-tetrahydroisoquinolin-2-ium-7-yl]pyridine-2-carboxamide

Systemtic Name: N-[2-[[(1S)-cyclohex-3-en-1-yl]methyl]-1,2,3,4-tetrahydroisoquinolin-2-ium-7-yl]pyridine-2-carboxamide Openeye Name: N-[2-[[(1S)-cyclohex-3-en-1-yl]methyl]-1,2,3,4-tetrahydroisoquinolin-2-ium-7-yl]pyridine-2-carboxamide CAS Name: N-[2-[[(1S)-1-cyclohex-3-enyl]methyl]-1,2,3,4-tetrahydroisoquinolin-2-ium-7-yl]-2-pyridinecarboxamide IUPAC Name: N-[2-[[(1S)-cyclohex-3-en-1-yl]methyl]-1,2,3,4-tetrahydroisoquinolin-2-ium-7-yl]pyridine-2-carboxamide Traditional Name: N-[2-[[(1S)-cyclohex-3-en-1-yl]methyl]-1,2,3,4-tetrahydroisoquinolin-2-ium-7-yl]picolinamide Formula: C22H26N3O+ MolecularWeight: 348.46134

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CC=C1)C[NH+]2CCC3=C(C2)C=C(C=C3)NC(=O)C4=CC=CC=N4

Isomeric SMILES

C1C[C@@H](CC=C1)C[NH+]2CCC3=C(C2)C=C(C=C3)NC(=O)C4=CC=CC=N4

InChI

InChI=1S/C22H25N3O/c26-22(21-8-4-5-12-23-21)24-20-10-9-18-11-13-25(16-19(18)14-20)15-17-6-2-1-3-7-17/h1-2,4-5,8-10,12,14,17H,3,6-7,11,13,15-16H2,(H,24,26)/p+1/t17-/m1/s1