1,3-bis[(4-methoxyphenyl)methyl]-2-(3-nitrophenyl)-1,3-diazinane

Systemtic Name: 1,3-bis[(4-methoxyphenyl)methyl]-2-(3-nitrophenyl)-1,3-diazinane Openeye Name: 1,3-bis[(4-methoxyphenyl)methyl]-2-(3-nitrophenyl)hexahydropyrimidine CAS Name: 1,3-bis[(4-methoxyphenyl)methyl]-2-(3-nitrophenyl)-1,3-diazinane IUPAC Name: 1,3-bis[(4-methoxyphenyl)methyl]-2-(3-nitrophenyl)-1,3-diazinane Traditional Name: 2-(3-nitrophenyl)-1,3-bis(p-anisyl)hexahydropyrimidine Formula: C26H29N3O4 MolecularWeight: 447.52616

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN2CCCN(C2C3=CC(=CC=C3)[N+](=O)[O-])CC4=CC=C(C=C4)OC

Isomeric SMILES

COC1=CC=C(C=C1)CN2CCCN(C2C3=CC(=CC=C3)[N+](=O)[O-])CC4=CC=C(C=C4)OC

InChI

InChI=1S/C26H29N3O4/c1-32-24-11-7-20(8-12-24)18-27-15-4-16-28(19-21-9-13-25(33-2)14-10-21)26(27)22-5-3-6-23(17-22)29(30)31/h3,5-14,17,26H,4,15-16,18-19H2,1-2H3