5-nitro-4-oxidanyl-2-[(E)-2-[1-(2-phenoxyethyl)indol-3-yl]ethenyl]-1H-pyrimidin-6-one

Systemtic Name: 5-nitro-4-oxidanyl-2-[(E)-2-[1-(2-phenoxyethyl)indol-3-yl]ethenyl]-1H-pyrimidin-6-one Openeye Name: 4-hydroxy-5-nitro-2-[(E)-2-[1-(2-phenoxyethyl)indol-3-yl]vinyl]-1H-pyrimidin-6-one CAS Name: 4-hydroxy-5-nitro-2-[(E)-2-[1-(2-phenoxyethyl)-3-indolyl]ethenyl]-1H-pyrimidin-6-one IUPAC Name: 4-hydroxy-5-nitro-2-[(E)-2-[1-(2-phenoxyethyl)indol-3-yl]ethenyl]-1H-pyrimidin-6-one Traditional Name: 4-hydroxy-5-nitro-2-[(E)-2-[1-(2-phenoxyethyl)indol-3-yl]vinyl]-1H-pyrimidin-6-one Formula: C22H18N4O5 MolecularWeight: 418.40212

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCCN2C=C(C3=CC=CC=C32)C=CC4=NC(=C(C(=O)N4)[N+](=O)[O-])O

Isomeric SMILES

C1=CC=C(C=C1)OCCN2C=C(C3=CC=CC=C32)/C=C/C4=NC(=C(C(=O)N4)[N+](=O)[O-])O

InChI

InChI=1S/C22H18N4O5/c27-21-20(26(29)30)22(28)24-19(23-21)11-10-15-14-25(18-9-5-4-8-17(15)18)12-13-31-16-6-2-1-3-7-16/h1-11,14H,12-13H2,(H2,23,24,27,28)/b11-10+