N-(2-morpholin-4-ium-4-ylethyl)-2-(4-propan-2-yloxyphenyl)quinoline-4-carboxamide

Systemtic Name: N-(2-morpholin-4-ium-4-ylethyl)-2-(4-propan-2-yloxyphenyl)quinoline-4-carboxamide Openeye Name: 2-(4-isopropoxyphenyl)-N-(2-morpholin-4-ium-4-ylethyl)quinoline-4-carboxamide CAS Name: N-[2-(4-morpholin-4-iumyl)ethyl]-2-(4-propan-2-yloxyphenyl)-4-quinolinecarboxamide IUPAC Name: N-(2-morpholin-4-ium-4-ylethyl)-2-(4-propan-2-yloxyphenyl)quinoline-4-carboxamide Traditional Name: 2-(4-isopropoxyphenyl)-N-(2-morpholin-4-ium-4-ylethyl)cinchoninamide Formula: C25H30N3O3+ MolecularWeight: 420.524

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NCC[NH+]4CCOCC4

Isomeric SMILES

CC(C)OC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NCC[NH+]4CCOCC4

InChI

InChI=1S/C25H29N3O3/c1-18(2)31-20-9-7-19(8-10-20)24-17-22(21-5-3-4-6-23(21)27-24)25(29)26-11-12-28-13-15-30-16-14-28/h3-10,17-18H,11-16H2,1-2H3,(H,26,29)/p+1