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

Systemtic Name: 4-naphthalen-2-yloxy-5-nitro-6-[4-(phenylmethyl)piperazin-1-yl]pyrimidine Openeye Name: 4-(4-benzylpiperazin-1-yl)-6-(2-naphthyloxy)-5-nitro-pyrimidine CAS Name: 4-(2-naphthalenyloxy)-5-nitro-6-[4-(phenylmethyl)-1-piperazinyl]pyrimidine IUPAC Name: 4-(4-benzylpiperazin-1-yl)-6-naphthalen-2-yloxy-5-nitropyrimidine Traditional Name: 4-(4-benzylpiperazino)-6-(2-naphthoxy)-5-nitro-pyrimidine Formula: C25H23N5O3 MolecularWeight: 441.48182

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)C3=C(C(=NC=N3)OC4=CC5=CC=CC=C5C=C4)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)C3=C(C(=NC=N3)OC4=CC5=CC=CC=C5C=C4)[N+](=O)[O-]

InChI

InChI=1S/C25H23N5O3/c31-30(32)23-24(29-14-12-28(13-15-29)17-19-6-2-1-3-7-19)26-18-27-25(23)33-22-11-10-20-8-4-5-9-21(20)16-22/h1-11,16,18H,12-15,17H2