4-[4-(3-chlorophenyl)piperazin-1-yl]-6-naphthalen-2-yloxy-5-nitro-pyrimidine

Systemtic Name: 4-[4-(3-chlorophenyl)piperazin-1-yl]-6-naphthalen-2-yloxy-5-nitro-pyrimidine Openeye Name: 4-[4-(3-chlorophenyl)piperazin-1-yl]-6-(2-naphthyloxy)-5-nitro-pyrimidine CAS Name: 4-[4-(3-chlorophenyl)-1-piperazinyl]-6-(2-naphthalenyloxy)-5-nitropyrimidine IUPAC Name: 4-[4-(3-chlorophenyl)piperazin-1-yl]-6-naphthalen-2-yloxy-5-nitropyrimidine Traditional Name: 4-[4-(3-chlorophenyl)piperazino]-6-(2-naphthoxy)-5-nitro-pyrimidine Formula: C24H20ClN5O3 MolecularWeight: 461.9003

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC(=CC=C2)Cl)C3=C(C(=NC=N3)OC4=CC5=CC=CC=C5C=C4)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C2=CC(=CC=C2)Cl)C3=C(C(=NC=N3)OC4=CC5=CC=CC=C5C=C4)[N+](=O)[O-]

InChI

InChI=1S/C24H20ClN5O3/c25-19-6-3-7-20(15-19)28-10-12-29(13-11-28)23-22(30(31)32)24(27-16-26-23)33-21-9-8-17-4-1-2-5-18(17)14-21/h1-9,14-16H,10-13H2