3-[4-(2-methoxyphenyl)piperazin-1-yl]propyl adamantane-1-carboxylate

Systemtic Name: 3-[4-(2-methoxyphenyl)piperazin-1-yl]propyl adamantane-1-carboxylate Openeye Name: 3-[4-(2-methoxyphenyl)piperazin-1-yl]propyl adamantane-1-carboxylate CAS Name: 1-adamantanecarboxylic acid 3-[4-(2-methoxyphenyl)-1-piperazinyl]propyl ester IUPAC Name: 3-[4-(2-methoxyphenyl)piperazin-1-yl]propyl adamantane-1-carboxylate Traditional Name: adamantane-1-carboxylic acid 3-[4-(2-methoxyphenyl)piperazino]propyl ester Formula: C25H36N2O3 MolecularWeight: 412.56494

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CCN(CC2)CCCOC(=O)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

COC1=CC=CC=C1N2CCN(CC2)CCCOC(=O)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C25H36N2O3/c1-29-23-6-3-2-5-22(23)27-10-8-26(9-11-27)7-4-12-30-24(28)25-16-19-13-20(17-25)15-21(14-19)18-25/h2-3,5-6,19-21H,4,7-18H2,1H3