4-[4-(diphenylmethyl)piperazin-1-yl]-6-naphthalen-2-yloxy-5-nitro-pyrimidine

Systemtic Name: 4-[4-(diphenylmethyl)piperazin-1-yl]-6-naphthalen-2-yloxy-5-nitro-pyrimidine Openeye Name: 4-(4-benzhydrylpiperazin-1-yl)-6-(2-naphthyloxy)-5-nitro-pyrimidine CAS Name: 4-[4-(diphenylmethyl)-1-piperazinyl]-6-(2-naphthalenyloxy)-5-nitropyrimidine IUPAC Name: 4-(4-benzhydrylpiperazin-1-yl)-6-naphthalen-2-yloxy-5-nitropyrimidine Traditional Name: 4-(4-benzhydrylpiperazino)-6-(2-naphthoxy)-5-nitro-pyrimidine Formula: C31H27N5O3 MolecularWeight: 517.57778

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C(=NC=N2)OC3=CC4=CC=CC=C4C=C3)[N+](=O)[O-])C(C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

C1CN(CCN1C2=C(C(=NC=N2)OC3=CC4=CC=CC=C4C=C3)[N+](=O)[O-])C(C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C31H27N5O3/c37-36(38)29-30(32-22-33-31(29)39-27-16-15-23-9-7-8-14-26(23)21-27)35-19-17-34(18-20-35)28(24-10-3-1-4-11-24)25-12-5-2-6-13-25/h1-16,21-22,28H,17-20H2