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

Systemtic Name: [3-butyl-6-(sulfanylmethyl)azulen-1-yl] ethyl carbonate Openeye Name: [3-butyl-6-(sulfanylmethyl)azulen-1-yl] ethyl carbonate CAS Name: carbonic acid [3-butyl-6-(mercaptomethyl)-1-azulenyl] ethyl ester IUPAC Name: [3-butyl-6-(sulfanylmethyl)azulen-1-yl] ethyl carbonate Traditional Name: carbonic acid [3-butyl-6-(mercaptomethyl)azulen-1-yl] ethyl ester Formula: C18H22O3S MolecularWeight: 318.43048

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C2C=CC(=CC=C2C(=C1)OC(=O)OCC)CS

Isomeric SMILES

CCCCC1=C2C=CC(=CC=C2C(=C1)OC(=O)OCC)CS

InChI

InChI=1S/C18H22O3S/c1-3-5-6-14-11-17(21-18(19)20-4-2)16-10-8-13(12-22)7-9-15(14)16/h7-11,22H,3-6,12H2,1-2H3