3-[4-(3-anthracen-9-ylcarbonyloxypropyl)piperazin-1-yl]propyl anthracene-9-carboxylate

Systemtic Name: 3-[4-(3-anthracen-9-ylcarbonyloxypropyl)piperazin-1-yl]propyl anthracene-9-carboxylate Openeye Name: 3-[4-[3-(anthracene-9-carbonyloxy)propyl]piperazin-1-yl]propyl anthracene-9-carboxylate CAS Name: 9-anthracenecarboxylic acid 3-[4-[3-[9-anthracenyl(oxo)methoxy]propyl]-1-piperazinyl]propyl ester IUPAC Name: 3-[4-[3-(anthracene-9-carbonyloxy)propyl]piperazin-1-yl]propyl anthracene-9-carboxylate Traditional Name: anthracene-9-carboxylic acid 3-[4-[3-(anthracene-9-carbonyloxy)propyl]piperazino]propyl ester Formula: C40H38N2O4 MolecularWeight: 610.74072

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCOC(=O)C2=C3C=CC=CC3=CC4=CC=CC=C42)CCCOC(=O)C5=C6C=CC=CC6=CC7=CC=CC=C75

Isomeric SMILES

C1CN(CCN1CCCOC(=O)C2=C3C=CC=CC3=CC4=CC=CC=C42)CCCOC(=O)C5=C6C=CC=CC6=CC7=CC=CC=C75

InChI

InChI=1S/C40H38N2O4/c43-39(37-33-15-5-1-11-29(33)27-30-12-2-6-16-34(30)37)45-25-9-19-41-21-23-42(24-22-41)20-10-26-46-40(44)38-35-17-7-3-13-31(35)28-32-14-4-8-18-36(32)38/h1-8,11-18,27-28H,9-10,19-26H2