6-[bis(phenylmethyl)amino]-5-nitro-1H-pyrimidin-4-one

Systemtic Name: 6-[bis(phenylmethyl)amino]-5-nitro-1H-pyrimidin-4-one Openeye Name: 6-(dibenzylamino)-5-nitro-1H-pyrimidin-4-one CAS Name: 6-[bis(phenylmethyl)amino]-5-nitro-1H-pyrimidin-4-one IUPAC Name: 6-(dibenzylamino)-5-nitro-1H-pyrimidin-4-one Traditional Name: 6-(dibenzylamino)-5-nitro-1H-pyrimidin-4-one Formula: C18H16N4O3 MolecularWeight: 336.34464

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN(CC2=CC=CC=C2)C3=C(C(=O)N=CN3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CN(CC2=CC=CC=C2)C3=C(C(=O)N=CN3)[N+](=O)[O-]

InChI

InChI=1S/C18H16N4O3/c23-18-16(22(24)25)17(19-13-20-18)21(11-14-7-3-1-4-8-14)12-15-9-5-2-6-10-15/h1-10,13H,11-12H2,(H,19,20,23)