[2-oxidanyl-4-[2-(propan-2-ylamino)ethanoyl]phenyl] octanoate

Systemtic Name: [2-oxidanyl-4-[2-(propan-2-ylamino)ethanoyl]phenyl] octanoate Openeye Name: [2-hydroxy-4-[2-(isopropylamino)acetyl]phenyl] octanoate CAS Name: octanoic acid [2-hydroxy-4-[1-oxo-2-(propan-2-ylamino)ethyl]phenyl] ester IUPAC Name: [2-hydroxy-4-[2-(propan-2-ylamino)acetyl]phenyl] octanoate Traditional Name: caprylic acid [2-hydroxy-4-[2-(isopropylamino)acetyl]phenyl] ester Formula: C19H29NO4 MolecularWeight: 335.43786

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)OC1=C(C=C(C=C1)C(=O)CNC(C)C)O

Isomeric SMILES

CCCCCCCC(=O)OC1=C(C=C(C=C1)C(=O)CNC(C)C)O

InChI

InChI=1S/C19H29NO4/c1-4-5-6-7-8-9-19(23)24-18-11-10-15(12-16(18)21)17(22)13-20-14(2)3/h10-12,14,20-21H,4-9,13H2,1-3H3