ethyl [3-propyl-6-(sulfanylmethyl)azulen-1-yl] carbonate

Systemtic Name: ethyl [3-propyl-6-(sulfanylmethyl)azulen-1-yl] carbonate Openeye Name: ethyl [3-propyl-6-(sulfanylmethyl)azulen-1-yl] carbonate CAS Name: carbonic acid ethyl [6-(mercaptomethyl)-3-propyl-1-azulenyl] ester IUPAC Name: ethyl [3-propyl-6-(sulfanylmethyl)azulen-1-yl] carbonate Traditional Name: carbonic acid ethyl [6-(mercaptomethyl)-3-propyl-azulen-1-yl] ester Formula: C17H20O3S MolecularWeight: 304.4039

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C2C=CC(=CC=C2C(=C1)OC(=O)OCC)CS

Isomeric SMILES

CCCC1=C2C=CC(=CC=C2C(=C1)OC(=O)OCC)CS

InChI

InChI=1S/C17H20O3S/c1-3-5-13-10-16(20-17(18)19-4-2)15-9-7-12(11-21)6-8-14(13)15/h6-10,21H,3-5,11H2,1-2H3