1-[5-methoxy-2-methyl-1-(phenylmethyl)indol-3-yl]-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)ethanone

Systemtic Name: 1-[5-methoxy-2-methyl-1-(phenylmethyl)indol-3-yl]-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)ethanone Openeye Name: 1-(1-benzyl-5-methoxy-2-methyl-indol-3-yl)-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)ethanone CAS Name: 1-[5-methoxy-2-methyl-1-(phenylmethyl)-3-indolyl]-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)ethanone IUPAC Name: 1-(1-benzyl-5-methoxy-2-methylindol-3-yl)-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)ethanone Traditional Name: 1-(1-benzyl-5-methoxy-2-methyl-indol-3-yl)-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)ethanone Formula: C28H29N2O2+ MolecularWeight: 425.54206

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1CC3=CC=CC=C3)C=CC(=C2)OC)C(=O)C[NH+]4CCC5=CC=CC=C5C4

Isomeric SMILES

CC1=C(C2=C(N1CC3=CC=CC=C3)C=CC(=C2)OC)C(=O)C[NH+]4CCC5=CC=CC=C5C4

InChI

InChI=1S/C28H28N2O2/c1-20-28(27(31)19-29-15-14-22-10-6-7-11-23(22)18-29)25-16-24(32-2)12-13-26(25)30(20)17-21-8-4-3-5-9-21/h3-13,16H,14-15,17-19H2,1-2H3/p+1