1,3-bis[(3,4-dimethoxyphenyl)methyl]-2-phenyl-1,3-diazinane

Systemtic Name: 1,3-bis[(3,4-dimethoxyphenyl)methyl]-2-phenyl-1,3-diazinane Openeye Name: 1,3-bis[(3,4-dimethoxyphenyl)methyl]-2-phenyl-hexahydropyrimidine CAS Name: 1,3-bis[(3,4-dimethoxyphenyl)methyl]-2-phenyl-1,3-diazinane IUPAC Name: 1,3-bis[(3,4-dimethoxyphenyl)methyl]-2-phenyl-1,3-diazinane Traditional Name: 2-phenyl-1,3-diveratryl-hexahydropyrimidine Formula: C28H34N2O4 MolecularWeight: 462.58056

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN2CCCN(C2C3=CC=CC=C3)CC4=CC(=C(C=C4)OC)OC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CN2CCCN(C2C3=CC=CC=C3)CC4=CC(=C(C=C4)OC)OC)OC

InChI

InChI=1S/C28H34N2O4/c1-31-24-13-11-21(17-26(24)33-3)19-29-15-8-16-30(28(29)23-9-6-5-7-10-23)20-22-12-14-25(32-2)27(18-22)34-4/h5-7,9-14,17-18,28H,8,15-16,19-20H2,1-4H3