[4-(2-azanylethyl)-2-hexanoyloxy-phenyl] hexanoate

Systemtic Name: [4-(2-azanylethyl)-2-hexanoyloxy-phenyl] hexanoate Openeye Name: [4-(2-aminoethyl)-2-hexanoyloxy-phenyl] hexanoate CAS Name: hexanoic acid [4-(2-aminoethyl)-2-(1-oxohexoxy)phenyl] ester IUPAC Name: [4-(2-aminoethyl)-2-hexanoyloxyphenyl] hexanoate Traditional Name: hexanoic acid [4-(2-aminoethyl)-2-caproyloxy-phenyl] ester Formula: C20H31NO4 MolecularWeight: 349.46444

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)OC1=C(C=C(C=C1)CCN)OC(=O)CCCCC

Isomeric SMILES

CCCCCC(=O)OC1=C(C=C(C=C1)CCN)OC(=O)CCCCC

InChI

InChI=1S/C20H31NO4/c1-3-5-7-9-19(22)24-17-12-11-16(13-14-21)15-18(17)25-20(23)10-8-6-4-2/h11-12,15H,3-10,13-14,21H2,1-2H3