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

Systemtic Name: 4-[4-(diphenylmethyl)piperazin-1-yl]-5-nitro-6-propan-2-yloxy-pyrimidine Openeye Name: 4-(4-benzhydrylpiperazin-1-yl)-6-isopropoxy-5-nitro-pyrimidine CAS Name: 4-[4-(diphenylmethyl)-1-piperazinyl]-5-nitro-6-propan-2-yloxypyrimidine IUPAC Name: 4-(4-benzhydrylpiperazin-1-yl)-5-nitro-6-propan-2-yloxypyrimidine Traditional Name: 4-(4-benzhydrylpiperazino)-6-isopropoxy-5-nitro-pyrimidine Formula: C24H27N5O3 MolecularWeight: 433.50288

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=NC=NC(=C1[N+](=O)[O-])N2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC(C)OC1=NC=NC(=C1[N+](=O)[O-])N2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C24H27N5O3/c1-18(2)32-24-22(29(30)31)23(25-17-26-24)28-15-13-27(14-16-28)21(19-9-5-3-6-10-19)20-11-7-4-8-12-20/h3-12,17-18,21H,13-16H2,1-2H3