[2-(3-bromanylpropyl)-3-ethoxy-azulen-1-yl] 2-(3-bromanylpropyl)-1-ethoxy-3-oxidanylidene-azulene-3a-carboxylate

Systemtic Name: [2-(3-bromanylpropyl)-3-ethoxy-azulen-1-yl] 2-(3-bromanylpropyl)-1-ethoxy-3-oxidanylidene-azulene-3a-carboxylate Openeye Name: [2-(3-bromopropyl)-3-ethoxy-azulen-1-yl] 2-(3-bromopropyl)-1-ethoxy-3-oxo-azulene-3a-carboxylate CAS Name: 2-(3-bromopropyl)-1-ethoxy-3-oxo-3a-azulenecarboxylic acid [2-(3-bromopropyl)-3-ethoxy-1-azulenyl] ester IUPAC Name: [2-(3-bromopropyl)-3-ethoxyazulen-1-yl] 2-(3-bromopropyl)-1-ethoxy-3-oxoazulene-3a-carboxylate Traditional Name: 2-(3-bromopropyl)-1-ethoxy-3-keto-azulene-3a-carboxylic acid [2-(3-bromopropyl)-3-ethoxy-azulen-1-yl] ester Formula: C31H32Br2O5 MolecularWeight: 644.39078

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C2C=CC=CC=C2C(=C1CCCBr)OC(=O)C34C=CC=CC=C3C(=C(C4=O)CCCBr)OCC

Isomeric SMILES

CCOC1=C2C=CC=CC=C2C(=C1CCCBr)OC(=O)C34C=CC=CC=C3C(=C(C4=O)CCCBr)OCC

InChI

InChI=1S/C31H32Br2O5/c1-3-36-26-21-13-7-5-8-14-22(21)27(23(26)15-11-19-32)38-30(35)31-18-10-6-9-17-25(31)28(37-4-2)24(29(31)34)16-12-20-33/h5-10,13-14,17-18H,3-4,11-12,15-16,19-20H2,1-2H3