5-nitro-2-[(E)-2-(1-propan-2-ylindol-3-yl)ethenyl]-1H-pyrimidine-4,6-dione

Systemtic Name: 5-nitro-2-[(E)-2-(1-propan-2-ylindol-3-yl)ethenyl]-1H-pyrimidine-4,6-dione Openeye Name: 2-[(E)-2-(1-isopropylindol-3-yl)vinyl]-5-nitro-1H-pyrimidine-4,6-dione CAS Name: 5-nitro-2-[(E)-2-(1-propan-2-yl-3-indolyl)ethenyl]-1H-pyrimidine-4,6-dione IUPAC Name: 5-nitro-2-[(E)-2-(1-propan-2-ylindol-3-yl)ethenyl]-1H-pyrimidine-4,6-dione Traditional Name: 2-[(E)-2-(1-isopropylindol-3-yl)vinyl]-5-nitro-1H-pyrimidine-4,6-quinone Formula: C17H16N4O4 MolecularWeight: 340.33334

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C=C(C2=CC=CC=C21)C=CC3=NC(=O)C(C(=O)N3)[N+](=O)[O-]

Isomeric SMILES

CC(C)N1C=C(C2=CC=CC=C21)/C=C/C3=NC(=O)C(C(=O)N3)[N+](=O)[O-]

InChI

InChI=1S/C17H16N4O4/c1-10(2)20-9-11(12-5-3-4-6-13(12)20)7-8-14-18-16(22)15(21(24)25)17(23)19-14/h3-10,15H,1-2H3,(H,18,19,22,23)/b8-7+