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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1N2CCN(CC2)C(=O)OCCN3CCN(CC3)CC4=CC5=C(C(=C4)OC)OCO5

Isomeric SMILES

CCOC1=CC=CC=C1N2CCN(CC2)C(=O)OCCN3CCN(CC3)CC4=CC5=C(C(=C4)OC)OCO5

InChI

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