[2,6-di(propan-2-yl)phenyl] 2-[4-(phenylmethyl)piperazin-1-yl]propanoate

Systemtic Name: [2,6-di(propan-2-yl)phenyl] 2-[4-(phenylmethyl)piperazin-1-yl]propanoate Openeye Name: (2,6-diisopropylphenyl) 2-(4-benzylpiperazin-1-yl)propanoate CAS Name: 2-[4-(phenylmethyl)-1-piperazinyl]propanoic acid [2,6-di(propan-2-yl)phenyl] ester IUPAC Name: [2,6-di(propan-2-yl)phenyl] 2-(4-benzylpiperazin-1-yl)propanoate Traditional Name: 2-(4-benzylpiperazino)propionic acid (2,6-diisopropylphenyl) ester Formula: C26H36N2O2 MolecularWeight: 408.57624

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C(=CC=C1)C(C)C)OC(=O)C(C)N2CCN(CC2)CC3=CC=CC=C3

Isomeric SMILES

CC(C)C1=C(C(=CC=C1)C(C)C)OC(=O)C(C)N2CCN(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C26H36N2O2/c1-19(2)23-12-9-13-24(20(3)4)25(23)30-26(29)21(5)28-16-14-27(15-17-28)18-22-10-7-6-8-11-22/h6-13,19-21H,14-18H2,1-5H3