2-[2-[2-[3-(dimethylazaniumyl)propoxy]naphthalen-1-yl]-1,3-thiazol-4-yl]ethanoate

Systemtic Name: 2-[2-[2-[3-(dimethylazaniumyl)propoxy]naphthalen-1-yl]-1,3-thiazol-4-yl]ethanoate Openeye Name: 2-[2-[2-[3-(dimethylammonio)propoxy]-1-naphthyl]thiazol-4-yl]acetate CAS Name: 2-[2-[2-[3-(dimethylammonio)propoxy]-1-naphthalenyl]-4-thiazolyl]acetate IUPAC Name: 2-[2-[2-[3-(dimethylazaniumyl)propoxy]naphthalen-1-yl]-1,3-thiazol-4-yl]acetate Traditional Name: 2-[2-[2-[3-(dimethylammonio)propoxy]-1-naphthyl]thiazol-4-yl]acetate Formula: C20H22N2O3S MolecularWeight: 370.46528

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCCOC1=C(C2=CC=CC=C2C=C1)C3=NC(=CS3)CC(=O)[O-]

Isomeric SMILES

C[NH+](C)CCCOC1=C(C2=CC=CC=C2C=C1)C3=NC(=CS3)CC(=O)[O-]

InChI

InChI=1S/C20H22N2O3S/c1-22(2)10-5-11-25-17-9-8-14-6-3-4-7-16(14)19(17)20-21-15(13-26-20)12-18(23)24/h3-4,6-9,13H,5,10-12H2,1-2H3,(H,23,24)