N-[3-[3-[(3,5-dimethoxyphenyl)methyl]-2-oxidanylidene-1,3-diazinan-1-yl]phenyl]-4-methyl-3-nitro-benzamide

Systemtic Name: N-[3-[3-[(3,5-dimethoxyphenyl)methyl]-2-oxidanylidene-1,3-diazinan-1-yl]phenyl]-4-methyl-3-nitro-benzamide Openeye Name: N-[3-[3-[(3,5-dimethoxyphenyl)methyl]-2-oxo-hexahydropyrimidin-1-yl]phenyl]-4-methyl-3-nitro-benzamide CAS Name: N-[3-[3-[(3,5-dimethoxyphenyl)methyl]-2-oxo-1,3-diazinan-1-yl]phenyl]-4-methyl-3-nitrobenzamide IUPAC Name: N-[3-[3-[(3,5-dimethoxyphenyl)methyl]-2-oxo-1,3-diazinan-1-yl]phenyl]-4-methyl-3-nitrobenzamide Traditional Name: N-[3-[3-(3,5-dimethoxybenzyl)-2-keto-hexahydropyrimidin-1-yl]phenyl]-4-methyl-3-nitro-benzamide Formula: C27H28N4O6 MolecularWeight: 504.53442

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2=CC=CC(=C2)N3CCCN(C3=O)CC4=CC(=CC(=C4)OC)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2=CC=CC(=C2)N3CCCN(C3=O)CC4=CC(=CC(=C4)OC)OC)[N+](=O)[O-]

InChI

InChI=1S/C27H28N4O6/c1-18-8-9-20(14-25(18)31(34)35)26(32)28-21-6-4-7-22(15-21)30-11-5-10-29(27(30)33)17-19-12-23(36-2)16-24(13-19)37-3/h4,6-9,12-16H,5,10-11,17H2,1-3H3,(H,28,32)