ethyl 2-[4-[2-azanyl-3-oxidanylidene-3-(pentylamino)propyl]phenoxy]-3-ethylperoxy-propanoate

Systemtic Name: ethyl 2-[4-[2-azanyl-3-oxidanylidene-3-(pentylamino)propyl]phenoxy]-3-ethylperoxy-propanoate Openeye Name: ethyl 2-[4-[2-amino-3-oxo-3-(pentylamino)propyl]phenoxy]-3-ethylperoxy-propanoate CAS Name: 2-[4-[2-amino-3-oxo-3-(pentylamino)propyl]phenoxy]-3-ethyldioxypropanoic acid ethyl ester IUPAC Name: ethyl 2-[4-[2-amino-3-oxo-3-(pentylamino)propyl]phenoxy]-3-ethylperoxypropanoate Traditional Name: 2-[4-[2-amino-3-(amylamino)-3-keto-propyl]phenoxy]-3-ethylperoxy-propionic acid ethyl ester Formula: C21H34N2O6 MolecularWeight: 410.50446

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=O)C(CC1=CC=C(C=C1)OC(COOCC)C(=O)OCC)N

Isomeric SMILES

CCCCCNC(=O)C(CC1=CC=C(C=C1)OC(COOCC)C(=O)OCC)N

InChI

InChI=1S/C21H34N2O6/c1-4-7-8-13-23-20(24)18(22)14-16-9-11-17(12-10-16)29-19(15-28-27-6-3)21(25)26-5-2/h9-12,18-19H,4-8,13-15,22H2,1-3H3,(H,23,24)