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

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-2-[3-(butylamino)-2-oxidanyl-propoxy]-1-phenyl-propan-1-one Openeye Name: 3-(1,3-benzodioxol-5-yl)-2-[3-(butylamino)-2-hydroxy-propoxy]-1-phenyl-propan-1-one CAS Name: 3-(1,3-benzodioxol-5-yl)-2-[3-(butylamino)-2-hydroxypropoxy]-1-phenyl-1-propanone IUPAC Name: 3-(1,3-benzodioxol-5-yl)-2-[3-(butylamino)-2-hydroxypropoxy]-1-phenylpropan-1-one Traditional Name: 3-(1,3-benzodioxol-5-yl)-2-[3-(butylamino)-2-hydroxy-propoxy]-1-phenyl-propan-1-one Formula: C23H29NO5 MolecularWeight: 399.48006

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H29NO5/c1-2-3-11-24-14-19(25)15-27-22(23(26)18-7-5-4-6-8-18)13-17-9-10-20-21(12-17)29-16-28-20/h4-10,12,19,22,24-25H,2-3,11,13-16H2,1H3