3,5-dimethyl-6-[4-[3-(5-nitro-2-prop-2-enoxy-phenoxy)propyl]piperazin-1-yl]-1H-pyrimidine-2,4-dione

Systemtic Name: 3,5-dimethyl-6-[4-[3-(5-nitro-2-prop-2-enoxy-phenoxy)propyl]piperazin-1-yl]-1H-pyrimidine-2,4-dione Openeye Name: 6-[4-[3-(2-allyloxy-5-nitro-phenoxy)propyl]piperazin-1-yl]-3,5-dimethyl-1H-pyrimidine-2,4-dione CAS Name: 3,5-dimethyl-6-[4-[3-(5-nitro-2-prop-2-enoxyphenoxy)propyl]-1-piperazinyl]-1H-pyrimidine-2,4-dione IUPAC Name: 3,5-dimethyl-6-[4-[3-(5-nitro-2-prop-2-enoxyphenoxy)propyl]piperazin-1-yl]-1H-pyrimidine-2,4-dione Traditional Name: 6-[4-[3-(2-allyloxy-5-nitro-phenoxy)propyl]piperazino]-3,5-dimethyl-uracil Formula: C22H29N5O6 MolecularWeight: 459.49556

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=O)N(C1=O)C)N2CCN(CC2)CCCOC3=C(C=CC(=C3)[N+](=O)[O-])OCC=C

Isomeric SMILES

CC1=C(NC(=O)N(C1=O)C)N2CCN(CC2)CCCOC3=C(C=CC(=C3)[N+](=O)[O-])OCC=C

InChI

InChI=1S/C22H29N5O6/c1-4-13-32-18-7-6-17(27(30)31)15-19(18)33-14-5-8-25-9-11-26(12-10-25)20-16(2)21(28)24(3)22(29)23-20/h4,6-7,15H,1,5,8-14H2,2-3H3,(H,23,29)