4-(4-ethylphenoxy)-6-[4-(4-methoxyphenyl)piperazin-1-yl]-5-nitro-pyrimidine

Systemtic Name: 4-(4-ethylphenoxy)-6-[4-(4-methoxyphenyl)piperazin-1-yl]-5-nitro-pyrimidine Openeye Name: 4-(4-ethylphenoxy)-6-[4-(4-methoxyphenyl)piperazin-1-yl]-5-nitro-pyrimidine CAS Name: 4-(4-ethylphenoxy)-6-[4-(4-methoxyphenyl)-1-piperazinyl]-5-nitropyrimidine IUPAC Name: 4-(4-ethylphenoxy)-6-[4-(4-methoxyphenyl)piperazin-1-yl]-5-nitropyrimidine Traditional Name: 4-(4-ethylphenoxy)-6-[4-(4-methoxyphenyl)piperazino]-5-nitro-pyrimidine Formula: C23H25N5O4 MolecularWeight: 435.4757

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)OC2=NC=NC(=C2[N+](=O)[O-])N3CCN(CC3)C4=CC=C(C=C4)OC

Isomeric SMILES

CCC1=CC=C(C=C1)OC2=NC=NC(=C2[N+](=O)[O-])N3CCN(CC3)C4=CC=C(C=C4)OC

InChI

InChI=1S/C23H25N5O4/c1-3-17-4-8-20(9-5-17)32-23-21(28(29)30)22(24-16-25-23)27-14-12-26(13-15-27)18-6-10-19(31-2)11-7-18/h4-11,16H,3,12-15H2,1-2H3