2-[4-[(7-methoxy-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl]ethyl 4-(2-methoxyphenyl)piperazine-1-carboxylate

Systemtic Name: 2-[4-[(7-methoxy-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl]ethyl 4-(2-methoxyphenyl)piperazine-1-carboxylate Openeye Name: 2-[4-[(7-methoxy-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl]ethyl 4-(2-methoxyphenyl)piperazine-1-carboxylate CAS Name: 4-(2-methoxyphenyl)-1-piperazinecarboxylic acid 2-[4-[(7-methoxy-1,3-benzodioxol-5-yl)methyl]-1-piperazinyl]ethyl ester IUPAC Name: 2-[4-[(7-methoxy-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl]ethyl 4-(2-methoxyphenyl)piperazine-1-carboxylate Traditional Name: 4-(2-methoxyphenyl)piperazine-1-carboxylic acid 2-[4-[(7-methoxy-1,3-benzodioxol-5-yl)methyl]piperazino]ethyl ester Formula: C27H36N4O6 MolecularWeight: 512.59794

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CCN(CC2)C(=O)OCCN3CCN(CC3)CC4=CC5=C(C(=C4)OC)OCO5

Isomeric SMILES

COC1=CC=CC=C1N2CCN(CC2)C(=O)OCCN3CCN(CC3)CC4=CC5=C(C(=C4)OC)OCO5

InChI

InChI=1S/C27H36N4O6/c1-33-23-6-4-3-5-22(23)30-11-13-31(14-12-30)27(32)35-16-15-28-7-9-29(10-8-28)19-21-17-24(34-2)26-25(18-21)36-20-37-26/h3-6,17-18H,7-16,19-20H2,1-2H3