[2-ethyl-3,6-dimethyl-4-[2-oxidanyl-3-(propan-2-ylamino)propoxy]phenyl] ethanoate

Systemtic Name: [2-ethyl-3,6-dimethyl-4-[2-oxidanyl-3-(propan-2-ylamino)propoxy]phenyl] ethanoate Openeye Name: [2-ethyl-4-[2-hydroxy-3-(isopropylamino)propoxy]-3,6-dimethyl-phenyl] acetate CAS Name: acetic acid [2-ethyl-4-[2-hydroxy-3-(propan-2-ylamino)propoxy]-3,6-dimethylphenyl] ester IUPAC Name: [2-ethyl-4-[2-hydroxy-3-(propan-2-ylamino)propoxy]-3,6-dimethylphenyl] acetate Traditional Name: acetic acid [2-ethyl-4-[2-hydroxy-3-(isopropylamino)propoxy]-3,6-dimethyl-phenyl] ester Formula: C18H29NO4 MolecularWeight: 323.42716

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC(=C1C)OCC(CNC(C)C)O)C)OC(=O)C

Isomeric SMILES

CCC1=C(C(=CC(=C1C)OCC(CNC(C)C)O)C)OC(=O)C

InChI

InChI=1S/C18H29NO4/c1-7-16-13(5)17(8-12(4)18(16)23-14(6)20)22-10-15(21)9-19-11(2)3/h8,11,15,19,21H,7,9-10H2,1-6H3