2-[2-(2-morpholin-4-ium-4-ylethoxy)naphthalen-1-yl]-1,3-thiazole-4-carboxylate

Systemtic Name: 2-[2-(2-morpholin-4-ium-4-ylethoxy)naphthalen-1-yl]-1,3-thiazole-4-carboxylate Openeye Name: 2-[2-(2-morpholin-4-ium-4-ylethoxy)-1-naphthyl]thiazole-4-carboxylate CAS Name: 2-[2-[2-(4-morpholin-4-iumyl)ethoxy]-1-naphthalenyl]-4-thiazolecarboxylate IUPAC Name: 2-[2-(2-morpholin-4-ium-4-ylethoxy)naphthalen-1-yl]-1,3-thiazole-4-carboxylate Traditional Name: 2-[2-(2-morpholin-4-ium-4-ylethoxy)-1-naphthyl]thiazole-4-carboxylate Formula: C20H20N2O4S MolecularWeight: 384.4488

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCOC2=C(C3=CC=CC=C3C=C2)C4=NC(=CS4)C(=O)[O-]

Isomeric SMILES

C1COCC[NH+]1CCOC2=C(C3=CC=CC=C3C=C2)C4=NC(=CS4)C(=O)[O-]

InChI

InChI=1S/C20H20N2O4S/c23-20(24)16-13-27-19(21-16)18-15-4-2-1-3-14(15)5-6-17(18)26-12-9-22-7-10-25-11-8-22/h1-6,13H,7-12H2,(H,23,24)