4-[4-[3-[(3-methoxyphenyl)methylamino]-2-oxidanyl-propoxy]phenyl]butan-2-one

Systemtic Name: 4-[4-[3-[(3-methoxyphenyl)methylamino]-2-oxidanyl-propoxy]phenyl]butan-2-one Openeye Name: 4-[4-[2-hydroxy-3-[(3-methoxyphenyl)methylamino]propoxy]phenyl]butan-2-one CAS Name: 4-[4-[2-hydroxy-3-[(3-methoxyphenyl)methylamino]propoxy]phenyl]-2-butanone IUPAC Name: 4-[4-[2-hydroxy-3-[(3-methoxyphenyl)methylamino]propoxy]phenyl]butan-2-one Traditional Name: 4-[4-[2-hydroxy-3-(m-anisylamino)propoxy]phenyl]butan-2-one Formula: C21H27NO4 MolecularWeight: 357.44338

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCC1=CC=C(C=C1)OCC(CNCC2=CC(=CC=C2)OC)O

Isomeric SMILES

CC(=O)CCC1=CC=C(C=C1)OCC(CNCC2=CC(=CC=C2)OC)O

InChI

InChI=1S/C21H27NO4/c1-16(23)6-7-17-8-10-20(11-9-17)26-15-19(24)14-22-13-18-4-3-5-21(12-18)25-2/h3-5,8-12,19,22,24H,6-7,13-15H2,1-2H3