2-[4-[6-[(4-methoxyphenyl)methylamino]-5-nitro-pyrimidin-4-yl]piperazin-1-yl]ethanol

Systemtic Name: 2-[4-[6-[(4-methoxyphenyl)methylamino]-5-nitro-pyrimidin-4-yl]piperazin-1-yl]ethanol Openeye Name: 2-[4-[6-[(4-methoxyphenyl)methylamino]-5-nitro-pyrimidin-4-yl]piperazin-1-yl]ethanol CAS Name: 2-[4-[6-[(4-methoxyphenyl)methylamino]-5-nitro-4-pyrimidinyl]-1-piperazinyl]ethanol IUPAC Name: 2-[4-[6-[(4-methoxyphenyl)methylamino]-5-nitropyrimidin-4-yl]piperazin-1-yl]ethanol Traditional Name: 2-[4-[5-nitro-6-(p-anisylamino)pyrimidin-4-yl]piperazino]ethanol Formula: C18H24N6O4 MolecularWeight: 388.42096

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CNC2=NC=NC(=C2[N+](=O)[O-])N3CCN(CC3)CCO

Isomeric SMILES

COC1=CC=C(C=C1)CNC2=NC=NC(=C2[N+](=O)[O-])N3CCN(CC3)CCO

InChI

InChI=1S/C18H24N6O4/c1-28-15-4-2-14(3-5-15)12-19-17-16(24(26)27)18(21-13-20-17)23-8-6-22(7-9-23)10-11-25/h2-5,13,25H,6-12H2,1H3,(H,19,20,21)