N'-[6-[4-(diphenylmethyl)piperazin-1-yl]-5-nitro-pyrimidin-4-yl]-2-methoxy-benzohydrazide

Systemtic Name: N'-[6-[4-(diphenylmethyl)piperazin-1-yl]-5-nitro-pyrimidin-4-yl]-2-methoxy-benzohydrazide Openeye Name: N'-[6-(4-benzhydrylpiperazin-1-yl)-5-nitro-pyrimidin-4-yl]-2-methoxy-benzohydrazide CAS Name: N'-[6-[4-(diphenylmethyl)-1-piperazinyl]-5-nitro-4-pyrimidinyl]-2-methoxybenzohydrazide IUPAC Name: N'-[6-(4-benzhydrylpiperazin-1-yl)-5-nitropyrimidin-4-yl]-2-methoxybenzohydrazide Traditional Name: N'-[6-(4-benzhydrylpiperazino)-5-nitro-pyrimidin-4-yl]-2-methoxy-benzohydrazide Formula: C29H29N7O4 MolecularWeight: 539.58506

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C(=O)NNC2=NC=NC(=C2[N+](=O)[O-])N3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

COC1=CC=CC=C1C(=O)NNC2=NC=NC(=C2[N+](=O)[O-])N3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C29H29N7O4/c1-40-24-15-9-8-14-23(24)29(37)33-32-27-26(36(38)39)28(31-20-30-27)35-18-16-34(17-19-35)25(21-10-4-2-5-11-21)22-12-6-3-7-13-22/h2-15,20,25H,16-19H2,1H3,(H,33,37)(H,30,31,32)