4-decyl-6-imidazol-1-yl-7-nitro-1H-quinoxaline-2,3-dione

Systemtic Name: 4-decyl-6-imidazol-1-yl-7-nitro-1H-quinoxaline-2,3-dione Openeye Name: 4-decyl-6-imidazol-1-yl-7-nitro-1H-quinoxaline-2,3-dione CAS Name: 4-decyl-6-(1-imidazolyl)-7-nitro-1H-quinoxaline-2,3-dione IUPAC Name: 4-decyl-6-imidazol-1-yl-7-nitro-1H-quinoxaline-2,3-dione Traditional Name: 4-decyl-6-imidazol-1-yl-7-nitro-1H-quinoxaline-2,3-quinone Formula: C21H27N5O4 MolecularWeight: 413.47018

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCN1C2=CC(=C(C=C2NC(=O)C1=O)[N+](=O)[O-])N3C=CN=C3

Isomeric SMILES

CCCCCCCCCCN1C2=CC(=C(C=C2NC(=O)C1=O)[N+](=O)[O-])N3C=CN=C3

InChI

InChI=1S/C21H27N5O4/c1-2-3-4-5-6-7-8-9-11-25-17-14-18(24-12-10-22-15-24)19(26(29)30)13-16(17)23-20(27)21(25)28/h10,12-15H,2-9,11H2,1H3,(H,23,27)