bis[4-[2-(3,4-dimethoxyphenyl)ethyl]-2,3-dihydro-1,4-benzoxazin-7-yl]methanone

Systemtic Name: bis[4-[2-(3,4-dimethoxyphenyl)ethyl]-2,3-dihydro-1,4-benzoxazin-7-yl]methanone Openeye Name: bis[4-[2-(3,4-dimethoxyphenyl)ethyl]-2,3-dihydro-1,4-benzoxazin-7-yl]methanone CAS Name: bis[4-[2-(3,4-dimethoxyphenyl)ethyl]-2,3-dihydro-1,4-benzoxazin-7-yl]methanone IUPAC Name: bis[4-[2-(3,4-dimethoxyphenyl)ethyl]-2,3-dihydro-1,4-benzoxazin-7-yl]methanone Traditional Name: bis(4-homoveratryl-2,3-dihydro-1,4-benzoxazin-7-yl)methanone Formula: C37H40N2O7 MolecularWeight: 624.7227

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCN2CCOC3=C2C=CC(=C3)C(=O)C4=CC5=C(C=C4)N(CCO5)CCC6=CC(=C(C=C6)OC)OC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCN2CCOC3=C2C=CC(=C3)C(=O)C4=CC5=C(C=C4)N(CCO5)CCC6=CC(=C(C=C6)OC)OC)OC

InChI

InChI=1S/C37H40N2O7/c1-41-31-11-5-25(21-35(31)43-3)13-15-38-17-19-45-33-23-27(7-9-29(33)38)37(40)28-8-10-30-34(24-28)46-20-18-39(30)16-14-26-6-12-32(42-2)36(22-26)44-4/h5-12,21-24H,13-20H2,1-4H3