2-(4-propan-2-yloxyphenyl)-N-pyridin-1-ium-4-yl-quinoline-4-carboxamide

Systemtic Name: 2-(4-propan-2-yloxyphenyl)-N-pyridin-1-ium-4-yl-quinoline-4-carboxamide Openeye Name: 2-(4-isopropoxyphenyl)-N-pyridin-1-ium-4-yl-quinoline-4-carboxamide CAS Name: 2-(4-propan-2-yloxyphenyl)-N-(4-pyridin-1-iumyl)-4-quinolinecarboxamide IUPAC Name: 2-(4-propan-2-yloxyphenyl)-N-pyridin-1-ium-4-ylquinoline-4-carboxamide Traditional Name: 2-(4-isopropoxyphenyl)-N-pyridin-1-ium-4-yl-cinchoninamide Formula: C24H22N3O2+ MolecularWeight: 384.45038

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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)NC4=CC=[NH+]C=C4

Isomeric SMILES

CC(C)OC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=CC=[NH+]C=C4

InChI

InChI=1S/C24H21N3O2/c1-16(2)29-19-9-7-17(8-10-19)23-15-21(20-5-3-4-6-22(20)27-23)24(28)26-18-11-13-25-14-12-18/h3-16H,1-2H3,(H,25,26,28)/p+1