2-(1,3-benzodioxol-5-yl)-7-[3-(dimethylamino)-1-phenyl-propoxy]-3-methyl-chromen-4-one

Systemtic Name: 2-(1,3-benzodioxol-5-yl)-7-[3-(dimethylamino)-1-phenyl-propoxy]-3-methyl-chromen-4-one Openeye Name: 2-(1,3-benzodioxol-5-yl)-7-[3-(dimethylamino)-1-phenyl-propoxy]-3-methyl-chromen-4-one CAS Name: 2-(1,3-benzodioxol-5-yl)-7-[3-(dimethylamino)-1-phenylpropoxy]-3-methyl-1-benzopyran-4-one IUPAC Name: 2-(1,3-benzodioxol-5-yl)-7-[3-(dimethylamino)-1-phenylpropoxy]-3-methylchromen-4-one Traditional Name: 2-(1,3-benzodioxol-5-yl)-7-[3-(dimethylamino)-1-phenyl-propoxy]-3-methyl-chromone Formula: C28H27NO5 MolecularWeight: 457.51768

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C(C1=O)C=CC(=C2)OC(CCN(C)C)C3=CC=CC=C3)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC1=C(OC2=C(C1=O)C=CC(=C2)OC(CCN(C)C)C3=CC=CC=C3)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C28H27NO5/c1-18-27(30)22-11-10-21(33-23(13-14-29(2)3)19-7-5-4-6-8-19)16-25(22)34-28(18)20-9-12-24-26(15-20)32-17-31-24/h4-12,15-16,23H,13-14,17H2,1-3H3