(5-chloranyl-7-iodanyl-quinolin-1-ium-8-yl) morpholine-4-carboxylate

Systemtic Name: (5-chloranyl-7-iodanyl-quinolin-1-ium-8-yl) morpholine-4-carboxylate Openeye Name: (5-chloro-7-iodo-quinolin-1-ium-8-yl) morpholine-4-carboxylate CAS Name: 4-morpholinecarboxylic acid (5-chloro-7-iodo-8-quinolin-1-iumyl) ester IUPAC Name: (5-chloro-7-iodoquinolin-1-ium-8-yl) morpholine-4-carboxylate Traditional Name: morpholine-4-carboxylic acid (5-chloro-7-iodo-quinolin-1-ium-8-yl) ester Formula: C14H13ClIN2O3+ MolecularWeight: 419.62209

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(=O)OC2=C(C=C(C3=C2[NH+]=CC=C3)Cl)I

Isomeric SMILES

C1COCCN1C(=O)OC2=C(C=C(C3=C2[NH+]=CC=C3)Cl)I

InChI

InChI=1S/C14H12ClIN2O3/c15-10-8-11(16)13(12-9(10)2-1-3-17-12)21-14(19)18-4-6-20-7-5-18/h1-3,8H,4-7H2/p+1