diethyl 6-tert-butyl-2-chloranyl-azulene-1,3-dicarboxylate

Systemtic Name: diethyl 6-tert-butyl-2-chloranyl-azulene-1,3-dicarboxylate Openeye Name: diethyl 6-tert-butyl-2-chloro-azulene-1,3-dicarboxylate CAS Name: 6-tert-butyl-2-chloroazulene-1,3-dicarboxylic acid diethyl ester IUPAC Name: diethyl 6-tert-butyl-2-chloroazulene-1,3-dicarboxylate Traditional Name: 6-tert-butyl-2-chloro-azulene-1,3-dicarboxylic acid diethyl ester Formula: C20H23ClO4 MolecularWeight: 362.84722

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C2C=CC(=CC=C2C(=C1Cl)C(=O)OCC)C(C)(C)C

Isomeric SMILES

CCOC(=O)C1=C2C=CC(=CC=C2C(=C1Cl)C(=O)OCC)C(C)(C)C

InChI

InChI=1S/C20H23ClO4/c1-6-24-18(22)15-13-10-8-12(20(3,4)5)9-11-14(13)16(17(15)21)19(23)25-7-2/h8-11H,6-7H2,1-5H3