(Z)-3-[2-[3-(dimethylazaniumyl)propoxy]naphthalen-1-yl]-2-thiophen-2-yl-prop-2-enoate

Systemtic Name: (Z)-3-[2-[3-(dimethylazaniumyl)propoxy]naphthalen-1-yl]-2-thiophen-2-yl-prop-2-enoate Openeye Name: (Z)-3-[2-[3-(dimethylammonio)propoxy]-1-naphthyl]-2-(2-thienyl)prop-2-enoate CAS Name: (Z)-3-[2-[3-(dimethylammonio)propoxy]-1-naphthalenyl]-2-thiophen-2-yl-2-propenoate IUPAC Name: (Z)-3-[2-[3-(dimethylazaniumyl)propoxy]naphthalen-1-yl]-2-thiophen-2-ylprop-2-enoate Traditional Name: (Z)-3-[2-[3-(dimethylammonio)propoxy]-1-naphthyl]-2-(2-thienyl)acrylate Formula: C22H23NO3S MolecularWeight: 381.48792

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H23NO3S/c1-23(2)12-6-13-26-20-11-10-16-7-3-4-8-17(16)18(20)15-19(22(24)25)21-9-5-14-27-21/h3-5,7-11,14-15H,6,12-13H2,1-2H3,(H,24,25)/b19-15+