[1-[4-(2-azanyl-2-oxidanylidene-ethyl)phenoxy]-3-(propan-2-ylamino)propan-2-yl] decanoate

Systemtic Name: [1-[4-(2-azanyl-2-oxidanylidene-ethyl)phenoxy]-3-(propan-2-ylamino)propan-2-yl] decanoate Openeye Name: [1-[[4-(2-amino-2-oxo-ethyl)phenoxy]methyl]-2-(isopropylamino)ethyl] decanoate CAS Name: decanoic acid [1-[4-(2-amino-2-oxoethyl)phenoxy]-3-(propan-2-ylamino)propan-2-yl] ester IUPAC Name: [1-[4-(2-amino-2-oxoethyl)phenoxy]-3-(propan-2-ylamino)propan-2-yl] decanoate Traditional Name: capric acid [1-[[4-(2-amino-2-keto-ethyl)phenoxy]methyl]-2-(isopropylamino)ethyl] ester Formula: C24H40N2O4 MolecularWeight: 420.5854

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC(=O)OC(CNC(C)C)COC1=CC=C(C=C1)CC(=O)N

Isomeric SMILES

CCCCCCCCCC(=O)OC(CNC(C)C)COC1=CC=C(C=C1)CC(=O)N

InChI

InChI=1S/C24H40N2O4/c1-4-5-6-7-8-9-10-11-24(28)30-22(17-26-19(2)3)18-29-21-14-12-20(13-15-21)16-23(25)27/h12-15,19,22,26H,4-11,16-18H2,1-3H3,(H2,25,27)