diethyl 1,1,2,2-tetracyano-7-methanoyl-9aH-quinolizine-3,4-dicarboxylate

Systemtic Name: diethyl 1,1,2,2-tetracyano-7-methanoyl-9aH-quinolizine-3,4-dicarboxylate Openeye Name: diethyl 1,1,2,2-tetracyano-7-formyl-9aH-quinolizine-3,4-dicarboxylate CAS Name: 1,1,2,2-tetracyano-7-formyl-9aH-quinolizine-3,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 1,1,2,2-tetracyano-7-formyl-9aH-quinolizine-3,4-dicarboxylate Traditional Name: 1,1,2,2-tetracyano-7-formyl-9aH-quinolizine-3,4-dicarboxylic acid diethyl ester Formula: C20H15N5O5 MolecularWeight: 405.3636

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N2C=C(C=CC2C(C1(C#N)C#N)(C#N)C#N)C=O)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1=C(N2C=C(C=CC2C(C1(C#N)C#N)(C#N)C#N)C=O)C(=O)OCC

InChI

InChI=1S/C20H15N5O5/c1-3-29-17(27)15-16(18(28)30-4-2)25-7-13(8-26)5-6-14(25)19(9-21,10-22)20(15,11-23)12-24/h5-8,14H,3-4H2,1-2H3