N-cyclopentyl-2-[2-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)ethanoylamino]benzamide

Systemtic Name: N-cyclopentyl-2-[2-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)ethanoylamino]benzamide Openeye Name: N-cyclopentyl-2-[[2-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)acetyl]amino]benzamide CAS Name: N-cyclopentyl-2-[[2-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)-1-oxoethyl]amino]benzamide IUPAC Name: N-cyclopentyl-2-[[2-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)acetyl]amino]benzamide Traditional Name: N-cyclopentyl-2-[[2-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)acetyl]amino]benzamide Formula: C25H32N3O4+ MolecularWeight: 438.53928

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C[NH+](CCC2=C1)CC(=O)NC3=CC=CC=C3C(=O)NC4CCCC4)OC

Isomeric SMILES

COC1=C(C=C2C[NH+](CCC2=C1)CC(=O)NC3=CC=CC=C3C(=O)NC4CCCC4)OC

InChI

InChI=1S/C25H31N3O4/c1-31-22-13-17-11-12-28(15-18(17)14-23(22)32-2)16-24(29)27-21-10-6-5-9-20(21)25(30)26-19-7-3-4-8-19/h5-6,9-10,13-14,19H,3-4,7-8,11-12,15-16H2,1-2H3,(H,26,30)(H,27,29)/p+1