4-[4-(diphenylmethyl)piperazin-1-yl]-5-nitro-6-pyridin-3-yloxy-pyrimidine

Systemtic Name: 4-[4-(diphenylmethyl)piperazin-1-yl]-5-nitro-6-pyridin-3-yloxy-pyrimidine Openeye Name: 4-(4-benzhydrylpiperazin-1-yl)-5-nitro-6-(3-pyridyloxy)pyrimidine CAS Name: 4-[4-(diphenylmethyl)-1-piperazinyl]-5-nitro-6-(3-pyridinyloxy)pyrimidine IUPAC Name: 4-(4-benzhydrylpiperazin-1-yl)-5-nitro-6-pyridin-3-yloxypyrimidine Traditional Name: 4-(4-benzhydrylpiperazino)-5-nitro-6-(3-pyridyloxy)pyrimidine Formula: C26H24N6O3 MolecularWeight: 468.50716

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C(=NC=N2)OC3=CN=CC=C3)[N+](=O)[O-])C(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1C2=C(C(=NC=N2)OC3=CN=CC=C3)[N+](=O)[O-])C(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C26H24N6O3/c33-32(34)24-25(28-19-29-26(24)35-22-12-7-13-27-18-22)31-16-14-30(15-17-31)23(20-8-3-1-4-9-20)21-10-5-2-6-11-21/h1-13,18-19,23H,14-17H2