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

Systemtic Name: 4-decyl-6-imidazol-1-yl-7-nitro-1H-quinoxaline-2,3-dione hydrochloride Openeye Name: 4-decyl-6-imidazol-1-yl-7-nitro-1H-quinoxaline-2,3-dione hydrochloride CAS Name: 4-decyl-6-(1-imidazolyl)-7-nitro-1H-quinoxaline-2,3-dione hydrochloride IUPAC Name: 4-decyl-6-imidazol-1-yl-7-nitro-1H-quinoxaline-2,3-dione hydrochloride Traditional Name: 4-decyl-6-imidazol-1-yl-7-nitro-1H-quinoxaline-2,3-quinone hydrochloride Formula: C21H28ClN5O4 MolecularWeight: 449.93112

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H27N5O4.ClH/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);1H