ethyl 4,6,8-trideuterio-2-ethoxy-azulene-1-carboxylate

Systemtic Name: ethyl 4,6,8-trideuterio-2-ethoxy-azulene-1-carboxylate Openeye Name: ethyl 4,6,8-trideuterio-2-ethoxy-azulene-1-carboxylate CAS Name: 4,6,8-trideuterio-2-ethoxy-1-azulenecarboxylic acid ethyl ester IUPAC Name: ethyl 4,6,8-trideuterio-2-ethoxyazulene-1-carboxylate Traditional Name: 4,6,8-trideuterio-2-ethoxy-azulene-1-carboxylic acid ethyl ester Formula: C15H16O3 MolecularWeight: 247.304225

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=CC=CC=CC2=C1C(=O)OCC

Isomeric SMILES

[2H]C1=CC(=C2C=C(C(=C2C(=C1)[2H])C(=O)OCC)OCC)[2H]

InChI

InChI=1S/C15H16O3/c1-3-17-13-10-11-8-6-5-7-9-12(11)14(13)15(16)18-4-2/h5-10H,3-4H2,1-2H3/i5D,8D,9D