N-(1,3-benzodioxol-5-yl)-2-(5,6,7,8-tetrahydroisoquinolin-2-ium-2-yl)ethanamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-2-(5,6,7,8-tetrahydroisoquinolin-2-ium-2-yl)ethanamide Openeye Name: N-(1,3-benzodioxol-5-yl)-2-(5,6,7,8-tetrahydroisoquinolin-2-ium-2-yl)acetamide CAS Name: N-(1,3-benzodioxol-5-yl)-2-(5,6,7,8-tetrahydroisoquinolin-2-ium-2-yl)acetamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-2-(5,6,7,8-tetrahydroisoquinolin-2-ium-2-yl)acetamide Traditional Name: N-(1,3-benzodioxol-5-yl)-2-(5,6,7,8-tetrahydroisoquinolin-2-ium-2-yl)acetamide Formula: C18H19N2O3+ MolecularWeight: 311.35506

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C=C[N+](=C2)CC(=O)NC3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1CCC2=C(C1)C=C[N+](=C2)CC(=O)NC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C18H18N2O3/c21-18(19-15-5-6-16-17(9-15)23-12-22-16)11-20-8-7-13-3-1-2-4-14(13)10-20/h5-10H,1-4,11-12H2/p+1