methyl 3-(5-ethylbenzo[c][1,2]benzothiazin-5-ium-6-yl)prop-2-enoate

Systemtic Name: methyl 3-(5-ethylbenzo[c][1,2]benzothiazin-5-ium-6-yl)prop-2-enoate Openeye Name: methyl 3-(5-ethylbenzo[c][1,2]benzothiazin-5-ium-6-yl)prop-2-enoate CAS Name: 3-(5-ethyl-6-benzo[c][1,2]benzothiazin-5-iumyl)-2-propenoic acid methyl ester IUPAC Name: methyl 3-(5-ethylbenzo[c][1,2]benzothiazin-5-ium-6-yl)prop-2-enoate Traditional Name: 3-(5-ethylbenzo[c][1,2]benzothiazin-5-ium-6-yl)acrylic acid methyl ester Formula: C18H18NO2S+ MolecularWeight: 312.40602

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[S+]1C2=CC=CC=C2C3=CC=CC=C3N1C=CC(=O)OC

Isomeric SMILES

CC[S+]1C2=CC=CC=C2C3=CC=CC=C3N1C=CC(=O)OC

InChI

InChI=1S/C18H18NO2S/c1-3-22-17-11-7-5-9-15(17)14-8-4-6-10-16(14)19(22)13-12-18(20)21-2/h4-13H,3H2,1-2H3/q+1