N-[4-[5-nitro-6-(4-prop-2-enylpiperazin-1-yl)pyrimidin-4-yl]oxyphenyl]ethanamide

Systemtic Name: N-[4-[5-nitro-6-(4-prop-2-enylpiperazin-1-yl)pyrimidin-4-yl]oxyphenyl]ethanamide Openeye Name: N-[4-[6-(4-allylpiperazin-1-yl)-5-nitro-pyrimidin-4-yl]oxyphenyl]acetamide CAS Name: N-[4-[[5-nitro-6-(4-prop-2-enyl-1-piperazinyl)-4-pyrimidinyl]oxy]phenyl]acetamide IUPAC Name: N-[4-[5-nitro-6-(4-prop-2-enylpiperazin-1-yl)pyrimidin-4-yl]oxyphenyl]acetamide Traditional Name: N-[4-[6-(4-allylpiperazino)-5-nitro-pyrimidin-4-yl]oxyphenyl]acetamide Formula: C19H22N6O4 MolecularWeight: 398.41578

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)OC2=NC=NC(=C2[N+](=O)[O-])N3CCN(CC3)CC=C

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)OC2=NC=NC(=C2[N+](=O)[O-])N3CCN(CC3)CC=C

InChI

InChI=1S/C19H22N6O4/c1-3-8-23-9-11-24(12-10-23)18-17(25(27)28)19(21-13-20-18)29-16-6-4-15(5-7-16)22-14(2)26/h3-7,13H,1,8-12H2,2H3,(H,22,26)