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

Systemtic Name: 2-[4-[(7-methoxy-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl]ethyl 4-(4-methoxyphenyl)-3-methyl-piperazine-1-carboxylate Openeye Name: 2-[4-[(7-methoxy-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl]ethyl 4-(4-methoxyphenyl)-3-methyl-piperazine-1-carboxylate CAS Name: 4-(4-methoxyphenyl)-3-methyl-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-(4-methoxyphenyl)-3-methylpiperazine-1-carboxylate Traditional Name: 4-(4-methoxyphenyl)-3-methyl-piperazine-1-carboxylic acid 2-[4-[(7-methoxy-1,3-benzodioxol-5-yl)methyl]piperazino]ethyl ester Formula: C28H38N4O6 MolecularWeight: 526.62452

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C2=CC=C(C=C2)OC)C(=O)OCCN3CCN(CC3)CC4=CC5=C(C(=C4)OC)OCO5

Isomeric SMILES

CC1CN(CCN1C2=CC=C(C=C2)OC)C(=O)OCCN3CCN(CC3)CC4=CC5=C(C(=C4)OC)OCO5

InChI

InChI=1S/C28H38N4O6/c1-21-18-31(12-13-32(21)23-4-6-24(34-2)7-5-23)28(33)36-15-14-29-8-10-30(11-9-29)19-22-16-25(35-3)27-26(17-22)37-20-38-27/h4-7,16-17,21H,8-15,18-20H2,1-3H3