2-(2-ethoxy-5-nitro-phenyl)-1,3-bis[(2-methoxyphenyl)methyl]-1,3-diazinane

Systemtic Name: 2-(2-ethoxy-5-nitro-phenyl)-1,3-bis[(2-methoxyphenyl)methyl]-1,3-diazinane Openeye Name: 2-(2-ethoxy-5-nitro-phenyl)-1,3-bis[(2-methoxyphenyl)methyl]hexahydropyrimidine CAS Name: 2-(2-ethoxy-5-nitrophenyl)-1,3-bis[(2-methoxyphenyl)methyl]-1,3-diazinane IUPAC Name: 2-(2-ethoxy-5-nitrophenyl)-1,3-bis[(2-methoxyphenyl)methyl]-1,3-diazinane Traditional Name: 2-(2-ethoxy-5-nitro-phenyl)-1,3-bis(o-anisyl)hexahydropyrimidine Formula: C28H33N3O5 MolecularWeight: 491.57872

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)[N+](=O)[O-])C2N(CCCN2CC3=CC=CC=C3OC)CC4=CC=CC=C4OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)[N+](=O)[O-])C2N(CCCN2CC3=CC=CC=C3OC)CC4=CC=CC=C4OC

InChI

InChI=1S/C28H33N3O5/c1-4-36-27-15-14-23(31(32)33)18-24(27)28-29(19-21-10-5-7-12-25(21)34-2)16-9-17-30(28)20-22-11-6-8-13-26(22)35-3/h5-8,10-15,18,28H,4,9,16-17,19-20H2,1-3H3