N-[[(1R)-1,2,3,4-tetrahydroisoquinolin-2-ium-1-yl]methyl]cyclohexanecarboxamide

Systemtic Name: N-[[(1R)-1,2,3,4-tetrahydroisoquinolin-2-ium-1-yl]methyl]cyclohexanecarboxamide Openeye Name: N-[[(1R)-1,2,3,4-tetrahydroisoquinolin-2-ium-1-yl]methyl]cyclohexanecarboxamide CAS Name: N-[[(1R)-1,2,3,4-tetrahydroisoquinolin-2-ium-1-yl]methyl]cyclohexanecarboxamide IUPAC Name: N-[[(1R)-1,2,3,4-tetrahydroisoquinolin-2-ium-1-yl]methyl]cyclohexanecarboxamide Traditional Name: N-[[(1R)-1,2,3,4-tetrahydroisoquinolin-2-ium-1-yl]methyl]cyclohexanecarboxamide Formula: C17H25N2O+ MolecularWeight: 273.3932

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)NCC2C3=CC=CC=C3CC[NH2+]2

Isomeric SMILES

C1CCC(CC1)C(=O)NC[C@H]2C3=CC=CC=C3CC[NH2+]2

InChI

InChI=1S/C17H24N2O/c20-17(14-7-2-1-3-8-14)19-12-16-15-9-5-4-6-13(15)10-11-18-16/h4-6,9,14,16,18H,1-3,7-8,10-12H2,(H,19,20)/p+1/t16-/m0/s1