3-(1,3-benzodioxol-5-yl)-2-[2-oxidanyl-3-(propylamino)propoxy]-1-phenyl-propan-1-one

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-2-[2-oxidanyl-3-(propylamino)propoxy]-1-phenyl-propan-1-one Openeye Name: 3-(1,3-benzodioxol-5-yl)-2-[2-hydroxy-3-(propylamino)propoxy]-1-phenyl-propan-1-one CAS Name: 3-(1,3-benzodioxol-5-yl)-2-[2-hydroxy-3-(propylamino)propoxy]-1-phenyl-1-propanone IUPAC Name: 3-(1,3-benzodioxol-5-yl)-2-[2-hydroxy-3-(propylamino)propoxy]-1-phenylpropan-1-one Traditional Name: 3-(1,3-benzodioxol-5-yl)-2-[2-hydroxy-3-(propylamino)propoxy]-1-phenyl-propan-1-one Formula: C22H27NO5 MolecularWeight: 385.45348

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Descriptors Computed from Structure

Canonical SMILES:

CCCNCC(COC(CC1=CC2=C(C=C1)OCO2)C(=O)C3=CC=CC=C3)O

Isomeric SMILES

CCCNCC(COC(CC1=CC2=C(C=C1)OCO2)C(=O)C3=CC=CC=C3)O

InChI

InChI=1S/C22H27NO5/c1-2-10-23-13-18(24)14-26-21(22(25)17-6-4-3-5-7-17)12-16-8-9-19-20(11-16)28-15-27-19/h3-9,11,18,21,23-24H,2,10,12-15H2,1H3