2-(1,3-benzodioxol-5-yl)-6-[3-(dimethylamino)-1-phenyl-propoxy]chromen-4-one

Systemtic Name: 2-(1,3-benzodioxol-5-yl)-6-[3-(dimethylamino)-1-phenyl-propoxy]chromen-4-one Openeye Name: 2-(1,3-benzodioxol-5-yl)-6-[3-(dimethylamino)-1-phenyl-propoxy]chromen-4-one CAS Name: 2-(1,3-benzodioxol-5-yl)-6-[3-(dimethylamino)-1-phenylpropoxy]-1-benzopyran-4-one IUPAC Name: 2-(1,3-benzodioxol-5-yl)-6-[3-(dimethylamino)-1-phenylpropoxy]chromen-4-one Traditional Name: 2-(1,3-benzodioxol-5-yl)-6-[3-(dimethylamino)-1-phenyl-propoxy]chromone Formula: C27H25NO5 MolecularWeight: 443.4911

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCC(C1=CC=CC=C1)OC2=CC3=C(C=C2)OC(=CC3=O)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

CN(C)CCC(C1=CC=CC=C1)OC2=CC3=C(C=C2)OC(=CC3=O)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C27H25NO5/c1-28(2)13-12-23(18-6-4-3-5-7-18)32-20-9-11-24-21(15-20)22(29)16-26(33-24)19-8-10-25-27(14-19)31-17-30-25/h3-11,14-16,23H,12-13,17H2,1-2H3