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

Systemtic Name: [4-(4-decoxyphenyl)carbonyloxyphenyl] 1-(2-ethylbutanoyl)piperidine-4-carboxylate Openeye Name: [4-(4-decoxybenzoyl)oxyphenyl] 1-(2-ethylbutanoyl)piperidine-4-carboxylate CAS Name: 1-(2-ethyl-1-oxobutyl)-4-piperidinecarboxylic acid [4-[(4-decoxyphenyl)-oxomethoxy]phenyl] ester IUPAC Name: [4-(4-decoxybenzoyl)oxyphenyl] 1-(2-ethylbutanoyl)piperidine-4-carboxylate Traditional Name: 1-(2-ethylbutanoyl)isonipecotic acid [4-(4-decoxybenzoyl)oxyphenyl] ester Formula: C35H49NO6 MolecularWeight: 579.76666

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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)CC

Isomeric SMILES

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

InChI

InChI=1S/C35H49NO6/c1-4-7-8-9-10-11-12-13-26-40-30-16-14-28(15-17-30)34(38)41-31-18-20-32(21-19-31)42-35(39)29-22-24-36(25-23-29)33(37)27(5-2)6-3/h14-21,27,29H,4-13,22-26H2,1-3H3