4-[4-(3-chlorophenyl)piperazin-1-yl]-6-ethoxy-5-nitro-pyrimidine

Systemtic Name: 4-[4-(3-chlorophenyl)piperazin-1-yl]-6-ethoxy-5-nitro-pyrimidine Openeye Name: 4-[4-(3-chlorophenyl)piperazin-1-yl]-6-ethoxy-5-nitro-pyrimidine CAS Name: 4-[4-(3-chlorophenyl)-1-piperazinyl]-6-ethoxy-5-nitropyrimidine IUPAC Name: 4-[4-(3-chlorophenyl)piperazin-1-yl]-6-ethoxy-5-nitropyrimidine Traditional Name: 4-[4-(3-chlorophenyl)piperazino]-6-ethoxy-5-nitro-pyrimidine Formula: C16H18ClN5O3 MolecularWeight: 363.79882

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=NC=NC(=C1[N+](=O)[O-])N2CCN(CC2)C3=CC(=CC=C3)Cl

Isomeric SMILES

CCOC1=NC=NC(=C1[N+](=O)[O-])N2CCN(CC2)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C16H18ClN5O3/c1-2-25-16-14(22(23)24)15(18-11-19-16)21-8-6-20(7-9-21)13-5-3-4-12(17)10-13/h3-5,10-11H,2,6-9H2,1H3