1-[4-[1-oxidanyl-3-(propan-2-ylamino)propoxy]-3-(pentoxymethyl)phenyl]ethanone

Systemtic Name: 1-[4-[1-oxidanyl-3-(propan-2-ylamino)propoxy]-3-(pentoxymethyl)phenyl]ethanone Openeye Name: 1-[4-[1-hydroxy-3-(isopropylamino)propoxy]-3-(pentoxymethyl)phenyl]ethanone CAS Name: 1-[4-[1-hydroxy-3-(propan-2-ylamino)propoxy]-3-(pentoxymethyl)phenyl]ethanone IUPAC Name: 1-[4-[1-hydroxy-3-(propan-2-ylamino)propoxy]-3-(pentoxymethyl)phenyl]ethanone Traditional Name: 1-[3-(amoxymethyl)-4-[1-hydroxy-3-(isopropylamino)propoxy]phenyl]ethanone Formula: C20H33NO4 MolecularWeight: 351.48032

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOCC1=C(C=CC(=C1)C(=O)C)OC(CCNC(C)C)O

Isomeric SMILES

CCCCCOCC1=C(C=CC(=C1)C(=O)C)OC(CCNC(C)C)O

InChI

InChI=1S/C20H33NO4/c1-5-6-7-12-24-14-18-13-17(16(4)22)8-9-19(18)25-20(23)10-11-21-15(2)3/h8-9,13,15,20-21,23H,5-7,10-12,14H2,1-4H3