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

Systemtic Name: octan-2-yl 4-[4-(4-octan-2-yloxycarbonylphenyl)piperazin-1-yl]benzoate Openeye Name: 1-methylheptyl 4-[4-[4-(1-methylheptoxycarbonyl)phenyl]piperazin-1-yl]benzoate CAS Name: 4-[4-[4-[octan-2-yloxy(oxo)methyl]phenyl]-1-piperazinyl]benzoic acid octan-2-yl ester IUPAC Name: octan-2-yl 4-[4-(4-octan-2-yloxycarbonylphenyl)piperazin-1-yl]benzoate Traditional Name: 4-[4-[4-(1-methylheptoxycarbonyl)phenyl]piperazino]benzoic acid 1-methylheptyl ester Formula: C34H50N2O4 MolecularWeight: 550.7718

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)OC(=O)C1=CC=C(C=C1)N2CCN(CC2)C3=CC=C(C=C3)C(=O)OC(C)CCCCCC

Isomeric SMILES

CCCCCCC(C)OC(=O)C1=CC=C(C=C1)N2CCN(CC2)C3=CC=C(C=C3)C(=O)OC(C)CCCCCC

InChI

InChI=1S/C34H50N2O4/c1-5-7-9-11-13-27(3)39-33(37)29-15-19-31(20-16-29)35-23-25-36(26-24-35)32-21-17-30(18-22-32)34(38)40-28(4)14-12-10-8-6-2/h15-22,27-28H,5-14,23-26H2,1-4H3