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

Systemtic Name: 4-nitro-N-[2-[2-oxidanylidene-3-(phenylmethyl)-1,3-diazinan-1-yl]phenyl]benzamide Openeye Name: N-[2-(3-benzyl-2-oxo-hexahydropyrimidin-1-yl)phenyl]-4-nitro-benzamide CAS Name: 4-nitro-N-[2-[2-oxo-3-(phenylmethyl)-1,3-diazinan-1-yl]phenyl]benzamide IUPAC Name: N-[2-(3-benzyl-2-oxo-1,3-diazinan-1-yl)phenyl]-4-nitrobenzamide Traditional Name: N-[2-(3-benzyl-2-keto-hexahydropyrimidin-1-yl)phenyl]-4-nitro-benzamide Formula: C24H22N4O4 MolecularWeight: 430.45588

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(=O)N(C1)C2=CC=CC=C2NC(=O)C3=CC=C(C=C3)[N+](=O)[O-])CC4=CC=CC=C4

Isomeric SMILES

C1CN(C(=O)N(C1)C2=CC=CC=C2NC(=O)C3=CC=C(C=C3)[N+](=O)[O-])CC4=CC=CC=C4

InChI

InChI=1S/C24H22N4O4/c29-23(19-11-13-20(14-12-19)28(31)32)25-21-9-4-5-10-22(21)27-16-6-15-26(24(27)30)17-18-7-2-1-3-8-18/h1-5,7-14H,6,15-17H2,(H,25,29)