methyl [3-(3-methylbutyl)azulen-5-yl] carbonate

Systemtic Name: methyl [3-(3-methylbutyl)azulen-5-yl] carbonate Openeye Name: (3-isopentylazulen-5-yl) methyl carbonate CAS Name: carbonic acid methyl [3-(3-methylbutyl)-5-azulenyl] ester IUPAC Name: methyl [3-(3-methylbutyl)azulen-5-yl] carbonate Traditional Name: carbonic acid (3-isoamylazulen-5-yl) methyl ester Formula: C17H20O3 MolecularWeight: 272.3389

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC1=CC=C2C1=CC(=CC=C2)OC(=O)OC

Isomeric SMILES

CC(C)CCC1=CC=C2C1=CC(=CC=C2)OC(=O)OC

InChI

InChI=1S/C17H20O3/c1-12(2)7-8-14-10-9-13-5-4-6-15(11-16(13)14)20-17(18)19-3/h4-6,9-12H,7-8H2,1-3H3