3-[3-[2-(3,4-dimethoxyphenyl)ethylamino]-2-oxidanyl-propoxy]-2-phenyl-chromen-4-one

Systemtic Name: 3-[3-[2-(3,4-dimethoxyphenyl)ethylamino]-2-oxidanyl-propoxy]-2-phenyl-chromen-4-one Openeye Name: 3-[3-[2-(3,4-dimethoxyphenyl)ethylamino]-2-hydroxy-propoxy]-2-phenyl-chromen-4-one CAS Name: 3-[3-[2-(3,4-dimethoxyphenyl)ethylamino]-2-hydroxypropoxy]-2-phenyl-1-benzopyran-4-one IUPAC Name: 3-[3-[2-(3,4-dimethoxyphenyl)ethylamino]-2-hydroxypropoxy]-2-phenylchromen-4-one Traditional Name: 3-[3-(homoveratrylamino)-2-hydroxy-propoxy]-2-phenyl-chromone Formula: C28H29NO6 MolecularWeight: 475.53296

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNCC(COC2=C(OC3=CC=CC=C3C2=O)C4=CC=CC=C4)O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNCC(COC2=C(OC3=CC=CC=C3C2=O)C4=CC=CC=C4)O)OC

InChI

InChI=1S/C28H29NO6/c1-32-24-13-12-19(16-25(24)33-2)14-15-29-17-21(30)18-34-28-26(31)22-10-6-7-11-23(22)35-27(28)20-8-4-3-5-9-20/h3-13,16,21,29-30H,14-15,17-18H2,1-2H3