[4-(4-decoxyphenyl)carbonyloxyphenyl] 1-(2-ethylpentanoyl)piperidine-4-carboxylate

Systemtic Name: [4-(4-decoxyphenyl)carbonyloxyphenyl] 1-(2-ethylpentanoyl)piperidine-4-carboxylate Openeye Name: [4-(4-decoxybenzoyl)oxyphenyl] 1-(2-ethylpentanoyl)piperidine-4-carboxylate CAS Name: 1-(2-ethyl-1-oxopentyl)-4-piperidinecarboxylic acid [4-[(4-decoxyphenyl)-oxomethoxy]phenyl] ester IUPAC Name: [4-(4-decoxybenzoyl)oxyphenyl] 1-(2-ethylpentanoyl)piperidine-4-carboxylate Traditional Name: 1-(2-ethylpentanoyl)isonipecotic acid [4-(4-decoxybenzoyl)oxyphenyl] ester Formula: C36H51NO6 MolecularWeight: 593.79324

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)OC(=O)C3CCN(CC3)C(=O)C(CC)CCC

Isomeric SMILES

CCCCCCCCCCOC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)OC(=O)C3CCN(CC3)C(=O)C(CC)CCC

InChI

InChI=1S/C36H51NO6/c1-4-7-8-9-10-11-12-13-27-41-31-17-15-29(16-18-31)35(39)42-32-19-21-33(22-20-32)43-36(40)30-23-25-37(26-24-30)34(38)28(6-3)14-5-2/h15-22,28,30H,4-14,23-27H2,1-3H3