3-[4-[2-(3,4-dimethoxyphenyl)ethylamino]butyl]-6,7-dimethoxy-2H-1,3-benzoxazin-4-one

Systemtic Name: 3-[4-[2-(3,4-dimethoxyphenyl)ethylamino]butyl]-6,7-dimethoxy-2H-1,3-benzoxazin-4-one Openeye Name: 3-[4-[2-(3,4-dimethoxyphenyl)ethylamino]butyl]-6,7-dimethoxy-2H-1,3-benzoxazin-4-one CAS Name: 3-[4-[2-(3,4-dimethoxyphenyl)ethylamino]butyl]-6,7-dimethoxy-2H-1,3-benzoxazin-4-one IUPAC Name: 3-[4-[2-(3,4-dimethoxyphenyl)ethylamino]butyl]-6,7-dimethoxy-2H-1,3-benzoxazin-4-one Traditional Name: 3-[4-(homoveratrylamino)butyl]-6,7-dimethoxy-2H-1,3-benzoxazin-4-one Formula: C24H32N2O6 MolecularWeight: 444.52068

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNCCCCN2COC3=CC(=C(C=C3C2=O)OC)OC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNCCCCN2COC3=CC(=C(C=C3C2=O)OC)OC)OC

InChI

InChI=1S/C24H32N2O6/c1-28-19-8-7-17(13-21(19)29-2)9-11-25-10-5-6-12-26-16-32-20-15-23(31-4)22(30-3)14-18(20)24(26)27/h7-8,13-15,25H,5-6,9-12,16H2,1-4H3