2-[(E)-2-[1-(4-methoxyphenyl)-2,5-dimethyl-pyrrol-3-yl]ethenyl]-5-nitro-4-oxidanyl-1H-pyrimidin-6-one

Systemtic Name: 2-[(E)-2-[1-(4-methoxyphenyl)-2,5-dimethyl-pyrrol-3-yl]ethenyl]-5-nitro-4-oxidanyl-1H-pyrimidin-6-one Openeye Name: 4-hydroxy-2-[(E)-2-[1-(4-methoxyphenyl)-2,5-dimethyl-pyrrol-3-yl]vinyl]-5-nitro-1H-pyrimidin-6-one CAS Name: 4-hydroxy-2-[(E)-2-[1-(4-methoxyphenyl)-2,5-dimethyl-3-pyrrolyl]ethenyl]-5-nitro-1H-pyrimidin-6-one IUPAC Name: 4-hydroxy-2-[(E)-2-[1-(4-methoxyphenyl)-2,5-dimethylpyrrol-3-yl]ethenyl]-5-nitro-1H-pyrimidin-6-one Traditional Name: 4-hydroxy-2-[(E)-2-[1-(4-methoxyphenyl)-2,5-dimethyl-pyrrol-3-yl]vinyl]-5-nitro-1H-pyrimidin-6-one Formula: C19H18N4O5 MolecularWeight: 382.37002

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=C(C=C2)OC)C)C=CC3=NC(=C(C(=O)N3)[N+](=O)[O-])O

Isomeric SMILES

CC1=CC(=C(N1C2=CC=C(C=C2)OC)C)/C=C/C3=NC(=C(C(=O)N3)[N+](=O)[O-])O

InChI

InChI=1S/C19H18N4O5/c1-11-10-13(12(2)22(11)14-5-7-15(28-3)8-6-14)4-9-16-20-18(24)17(23(26)27)19(25)21-16/h4-10H,1-3H3,(H2,20,21,24,25)/b9-4+