N-[2-[(5-ethanoylthiophen-3-yl)methyl]-1,2,3,4-tetrahydroisoquinolin-2-ium-7-yl]-2-methoxy-benzamide

Systemtic Name: N-[2-[(5-ethanoylthiophen-3-yl)methyl]-1,2,3,4-tetrahydroisoquinolin-2-ium-7-yl]-2-methoxy-benzamide Openeye Name: N-[2-[(5-acetyl-3-thienyl)methyl]-1,2,3,4-tetrahydroisoquinolin-2-ium-7-yl]-2-methoxy-benzamide CAS Name: N-[2-[(5-acetyl-3-thiophenyl)methyl]-1,2,3,4-tetrahydroisoquinolin-2-ium-7-yl]-2-methoxybenzamide IUPAC Name: N-[2-[(5-acetylthiophen-3-yl)methyl]-1,2,3,4-tetrahydroisoquinolin-2-ium-7-yl]-2-methoxybenzamide Traditional Name: N-[2-[(5-acetyl-3-thienyl)methyl]-1,2,3,4-tetrahydroisoquinolin-2-ium-7-yl]-2-methoxy-benzamide Formula: C24H25N2O3S+ MolecularWeight: 421.5319

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CS1)C[NH+]2CCC3=C(C2)C=C(C=C3)NC(=O)C4=CC=CC=C4OC

Isomeric SMILES

CC(=O)C1=CC(=CS1)C[NH+]2CCC3=C(C2)C=C(C=C3)NC(=O)C4=CC=CC=C4OC

InChI

InChI=1S/C24H24N2O3S/c1-16(27)23-11-17(15-30-23)13-26-10-9-18-7-8-20(12-19(18)14-26)25-24(28)21-5-3-4-6-22(21)29-2/h3-8,11-12,15H,9-10,13-14H2,1-2H3,(H,25,28)/p+1