methyl 2-[2-(1-methylindol-2-yl)-1,3-dithian-2-yl]ethanoate

Systemtic Name: methyl 2-[2-(1-methylindol-2-yl)-1,3-dithian-2-yl]ethanoate Openeye Name: methyl 2-[2-(1-methylindol-2-yl)-1,3-dithian-2-yl]acetate CAS Name: 2-[2-(1-methyl-2-indolyl)-1,3-dithian-2-yl]acetic acid methyl ester IUPAC Name: methyl 2-[2-(1-methylindol-2-yl)-1,3-dithian-2-yl]acetate Traditional Name: 2-[2-(1-methylindol-2-yl)-1,3-dithian-2-yl]acetic acid methyl ester Formula: C16H19NO2S2 MolecularWeight: 321.45756

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C=C1C3(SCCCS3)CC(=O)OC

Isomeric SMILES

CN1C2=CC=CC=C2C=C1C3(SCCCS3)CC(=O)OC

InChI

InChI=1S/C16H19NO2S2/c1-17-13-7-4-3-6-12(13)10-14(17)16(11-15(18)19-2)20-8-5-9-21-16/h3-4,6-7,10H,5,8-9,11H2,1-2H3