2-ethoxy-10-methyl-6-nitro-9-(pyridin-4-ylmethyl)acridin-10-ium iodide

Systemtic Name: 2-ethoxy-10-methyl-6-nitro-9-(pyridin-4-ylmethyl)acridin-10-ium iodide Openeye Name: 2-ethoxy-10-methyl-6-nitro-9-(4-pyridylmethyl)acridin-10-ium iodide CAS Name: 2-ethoxy-10-methyl-6-nitro-9-(pyridin-4-ylmethyl)acridin-10-ium iodide IUPAC Name: 2-ethoxy-10-methyl-6-nitro-9-(pyridin-4-ylmethyl)acridin-10-ium iodide Traditional Name: 2-ethoxy-10-methyl-6-nitro-9-(4-pyridylmethyl)acridin-10-ium iodide Formula: C22H20IN3O3 MolecularWeight: 501.31697

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)[N+](=C3C=C(C=CC3=C2CC4=CC=NC=C4)[N+](=O)[O-])C.[I-]

Isomeric SMILES

CCOC1=CC2=C(C=C1)[N+](=C3C=C(C=CC3=C2CC4=CC=NC=C4)[N+](=O)[O-])C.[I-]

InChI

InChI=1S/C22H20N3O3.HI/c1-3-28-17-5-7-21-20(14-17)19(12-15-8-10-23-11-9-15)18-6-4-16(25(26)27)13-22(18)24(21)2;/h4-11,13-14H,3,12H2,1-2H3;1H/q+1;/p-1