pentan-2-yl 4-[4-(4-pentan-2-yloxycarbonylphenyl)piperazin-1-yl]benzoate

Systemtic Name: pentan-2-yl 4-[4-(4-pentan-2-yloxycarbonylphenyl)piperazin-1-yl]benzoate Openeye Name: 1-methylbutyl 4-[4-[4-(1-methylbutoxycarbonyl)phenyl]piperazin-1-yl]benzoate CAS Name: 4-[4-[4-[oxo(pentan-2-yloxy)methyl]phenyl]-1-piperazinyl]benzoic acid pentan-2-yl ester IUPAC Name: pentan-2-yl 4-[4-(4-pentan-2-yloxycarbonylphenyl)piperazin-1-yl]benzoate Traditional Name: 4-[4-[4-(1-methylbutoxycarbonyl)phenyl]piperazino]benzoic acid 1-methylbutyl ester Formula: C28H38N2O4 MolecularWeight: 466.61232

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)OC(=O)C1=CC=C(C=C1)N2CCN(CC2)C3=CC=C(C=C3)C(=O)OC(C)CCC

Isomeric SMILES

CCCC(C)OC(=O)C1=CC=C(C=C1)N2CCN(CC2)C3=CC=C(C=C3)C(=O)OC(C)CCC

InChI

InChI=1S/C28H38N2O4/c1-5-7-21(3)33-27(31)23-9-13-25(14-10-23)29-17-19-30(20-18-29)26-15-11-24(12-16-26)28(32)34-22(4)8-6-2/h9-16,21-22H,5-8,17-20H2,1-4H3