diethyl 2-cyano-6-pyrrolidin-1-yl-azulene-1,3-dicarboxylate

Systemtic Name: diethyl 2-cyano-6-pyrrolidin-1-yl-azulene-1,3-dicarboxylate Openeye Name: diethyl 2-cyano-6-pyrrolidin-1-yl-azulene-1,3-dicarboxylate CAS Name: 2-cyano-6-(1-pyrrolidinyl)azulene-1,3-dicarboxylic acid diethyl ester IUPAC Name: diethyl 2-cyano-6-pyrrolidin-1-ylazulene-1,3-dicarboxylate Traditional Name: 2-cyano-6-pyrrolidino-azulene-1,3-dicarboxylic acid diethyl ester Formula: C21H22N2O4 MolecularWeight: 366.41038

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C2C=CC(=CC=C2C(=C1C#N)C(=O)OCC)N3CCCC3

Isomeric SMILES

CCOC(=O)C1=C2C=CC(=CC=C2C(=C1C#N)C(=O)OCC)N3CCCC3

InChI

InChI=1S/C21H22N2O4/c1-3-26-20(24)18-15-9-7-14(23-11-5-6-12-23)8-10-16(15)19(17(18)13-22)21(25)27-4-2/h7-10H,3-6,11-12H2,1-2H3