6-[2-[4-[bis(2-chloroethyl)amino]phenyl]ethenyl]-5-nitro-1H-pyrimidine-2,4-dione

Systemtic Name: 6-[2-[4-[bis(2-chloroethyl)amino]phenyl]ethenyl]-5-nitro-1H-pyrimidine-2,4-dione Openeye Name: 6-[2-[4-[bis(2-chloroethyl)amino]phenyl]vinyl]-5-nitro-1H-pyrimidine-2,4-dione CAS Name: 6-[2-[4-[bis(2-chloroethyl)amino]phenyl]ethenyl]-5-nitro-1H-pyrimidine-2,4-dione IUPAC Name: 6-[2-[4-[bis(2-chloroethyl)amino]phenyl]ethenyl]-5-nitro-1H-pyrimidine-2,4-dione Traditional Name: 6-[2-[4-[bis(2-chloroethyl)amino]phenyl]vinyl]-5-nitro-uracil Formula: C16H16Cl2N4O4 MolecularWeight: 399.22864

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C=CC2=C(C(=O)NC(=O)N2)[N+](=O)[O-])N(CCCl)CCCl

Isomeric SMILES

C1=CC(=CC=C1C=CC2=C(C(=O)NC(=O)N2)[N+](=O)[O-])N(CCCl)CCCl

InChI

InChI=1S/C16H16Cl2N4O4/c17-7-9-21(10-8-18)12-4-1-11(2-5-12)3-6-13-14(22(25)26)15(23)20-16(24)19-13/h1-6H,7-10H2,(H2,19,20,23,24)