[4-[2-(octylamino)-2-oxidanylidene-ethyl]-2-propan-2-yl-phenyl] heptanoate

Systemtic Name: [4-[2-(octylamino)-2-oxidanylidene-ethyl]-2-propan-2-yl-phenyl] heptanoate Openeye Name: [2-isopropyl-4-[2-(octylamino)-2-oxo-ethyl]phenyl] heptanoate CAS Name: heptanoic acid [4-[2-(octylamino)-2-oxoethyl]-2-propan-2-ylphenyl] ester IUPAC Name: [4-[2-(octylamino)-2-oxoethyl]-2-propan-2-ylphenyl] heptanoate Traditional Name: enanthic acid [2-isopropyl-4-[2-keto-2-(octylamino)ethyl]phenyl] ester Formula: C26H43NO3 MolecularWeight: 417.62452

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCNC(=O)CC1=CC(=C(C=C1)OC(=O)CCCCCC)C(C)C

Isomeric SMILES

CCCCCCCCNC(=O)CC1=CC(=C(C=C1)OC(=O)CCCCCC)C(C)C

InChI

InChI=1S/C26H43NO3/c1-5-7-9-11-12-14-18-27-25(28)20-22-16-17-24(23(19-22)21(3)4)30-26(29)15-13-10-8-6-2/h16-17,19,21H,5-15,18,20H2,1-4H3,(H,27,28)