3-(2-methoxyphenyl)-N-[2-(quinolin-6-ylmethyl)-1,2,3,4-tetrahydroisoquinolin-2-ium-7-yl]propanamide

Systemtic Name: 3-(2-methoxyphenyl)-N-[2-(quinolin-6-ylmethyl)-1,2,3,4-tetrahydroisoquinolin-2-ium-7-yl]propanamide Openeye Name: 3-(2-methoxyphenyl)-N-[2-(6-quinolylmethyl)-1,2,3,4-tetrahydroisoquinolin-2-ium-7-yl]propanamide CAS Name: 3-(2-methoxyphenyl)-N-[2-(6-quinolinylmethyl)-1,2,3,4-tetrahydroisoquinolin-2-ium-7-yl]propanamide IUPAC Name: 3-(2-methoxyphenyl)-N-[2-(quinolin-6-ylmethyl)-1,2,3,4-tetrahydroisoquinolin-2-ium-7-yl]propanamide Traditional Name: 3-(2-methoxyphenyl)-N-[2-(6-quinolylmethyl)-1,2,3,4-tetrahydroisoquinolin-2-ium-7-yl]propionamide Formula: C29H30N3O2+ MolecularWeight: 452.5674

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1CCC(=O)NC2=CC3=C(CC[NH+](C3)CC4=CC5=C(C=C4)N=CC=C5)C=C2

Isomeric SMILES

COC1=CC=CC=C1CCC(=O)NC2=CC3=C(CC[NH+](C3)CC4=CC5=C(C=C4)N=CC=C5)C=C2

InChI

InChI=1S/C29H29N3O2/c1-34-28-7-3-2-5-23(28)10-13-29(33)31-26-11-9-22-14-16-32(20-25(22)18-26)19-21-8-12-27-24(17-21)6-4-15-30-27/h2-9,11-12,15,17-18H,10,13-14,16,19-20H2,1H3,(H,31,33)/p+1