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

Systemtic Name: diethyl 2-bromanyl-6-pyrrolidin-1-yl-azulene-1,3-dicarboxylate Openeye Name: diethyl 2-bromo-6-pyrrolidin-1-yl-azulene-1,3-dicarboxylate CAS Name: 2-bromo-6-(1-pyrrolidinyl)azulene-1,3-dicarboxylic acid diethyl ester IUPAC Name: diethyl 2-bromo-6-pyrrolidin-1-ylazulene-1,3-dicarboxylate Traditional Name: 2-bromo-6-pyrrolidino-azulene-1,3-dicarboxylic acid diethyl ester Formula: C20H22BrNO4 MolecularWeight: 420.29698

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C2C=CC(=CC=C2C(=C1Br)C(=O)OCC)N3CCCC3

Isomeric SMILES

CCOC(=O)C1=C2C=CC(=CC=C2C(=C1Br)C(=O)OCC)N3CCCC3

InChI

InChI=1S/C20H22BrNO4/c1-3-25-19(23)16-14-9-7-13(22-11-5-6-12-22)8-10-15(14)17(18(16)21)20(24)26-4-2/h7-10H,3-6,11-12H2,1-2H3