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

Systemtic Name: 5-nitro-4-[4-(phenylmethyl)piperazin-1-yl]-6-propan-2-yloxy-pyrimidine Openeye Name: 4-(4-benzylpiperazin-1-yl)-6-isopropoxy-5-nitro-pyrimidine CAS Name: 5-nitro-4-[4-(phenylmethyl)-1-piperazinyl]-6-propan-2-yloxypyrimidine IUPAC Name: 4-(4-benzylpiperazin-1-yl)-5-nitro-6-propan-2-yloxypyrimidine Traditional Name: 4-(4-benzylpiperazino)-6-isopropoxy-5-nitro-pyrimidine Formula: C18H23N5O3 MolecularWeight: 357.40692

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=NC=NC(=C1[N+](=O)[O-])N2CCN(CC2)CC3=CC=CC=C3

Isomeric SMILES

CC(C)OC1=NC=NC(=C1[N+](=O)[O-])N2CCN(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C18H23N5O3/c1-14(2)26-18-16(23(24)25)17(19-13-20-18)22-10-8-21(9-11-22)12-15-6-4-3-5-7-15/h3-7,13-14H,8-12H2,1-2H3