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

Systemtic Name: 3-[4-[2-(3,4-dimethoxyphenyl)ethyl-methyl-amino]butyl]-6,7-dimethoxy-2H-1,3-benzoxazin-4-one Openeye Name: 3-[4-[2-(3,4-dimethoxyphenyl)ethyl-methyl-amino]butyl]-6,7-dimethoxy-2H-1,3-benzoxazin-4-one CAS Name: 3-[4-[2-(3,4-dimethoxyphenyl)ethyl-methylamino]butyl]-6,7-dimethoxy-2H-1,3-benzoxazin-4-one IUPAC Name: 3-[4-[2-(3,4-dimethoxyphenyl)ethyl-methylamino]butyl]-6,7-dimethoxy-2H-1,3-benzoxazin-4-one Traditional Name: 3-[4-[homoveratryl(methyl)amino]butyl]-6,7-dimethoxy-2H-1,3-benzoxazin-4-one Formula: C25H34N2O6 MolecularWeight: 458.54726

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCCN1COC2=CC(=C(C=C2C1=O)OC)OC)CCC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CN(CCCCN1COC2=CC(=C(C=C2C1=O)OC)OC)CCC3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C25H34N2O6/c1-26(13-10-18-8-9-20(29-2)22(14-18)30-3)11-6-7-12-27-17-33-21-16-24(32-5)23(31-4)15-19(21)25(27)28/h8-9,14-16H,6-7,10-13,17H2,1-5H3