dimethyl 1-cyanoazulene-5,6-dicarboxylate

Systemtic Name: dimethyl 1-cyanoazulene-5,6-dicarboxylate Openeye Name: dimethyl 1-cyanoazulene-5,6-dicarboxylate CAS Name: 1-cyanoazulene-5,6-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 1-cyanoazulene-5,6-dicarboxylate Traditional Name: 1-cyanoazulene-5,6-dicarboxylic acid dimethyl ester Formula: C15H11NO4 MolecularWeight: 269.25214

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=C2C=CC(=C2C=C1)C#N)C(=O)OC

Isomeric SMILES

COC(=O)C1=C(C=C2C=CC(=C2C=C1)C#N)C(=O)OC

InChI

InChI=1S/C15H11NO4/c1-19-14(17)12-6-5-11-9(3-4-10(11)8-16)7-13(12)15(18)20-2/h3-7H,1-2H3