2-chloranyl-N-(2-cyclohexyl-4-oxidanylidene-quinazolin-3-yl)-3,5-dinitro-benzamide

Systemtic Name: 2-chloranyl-N-(2-cyclohexyl-4-oxidanylidene-quinazolin-3-yl)-3,5-dinitro-benzamide Openeye Name: 2-chloro-N-(2-cyclohexyl-4-oxo-quinazolin-3-yl)-3,5-dinitro-benzamide CAS Name: 2-chloro-N-(2-cyclohexyl-4-oxo-3-quinazolinyl)-3,5-dinitrobenzamide IUPAC Name: 2-chloro-N-(2-cyclohexyl-4-oxoquinazolin-3-yl)-3,5-dinitrobenzamide Traditional Name: 2-chloro-N-(2-cyclohexyl-4-keto-quinazolin-3-yl)-3,5-dinitro-benzamide Formula: C21H18ClN5O6 MolecularWeight: 471.85052

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=NC3=CC=CC=C3C(=O)N2NC(=O)C4=CC(=CC(=C4Cl)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1CCC(CC1)C2=NC3=CC=CC=C3C(=O)N2NC(=O)C4=CC(=CC(=C4Cl)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C21H18ClN5O6/c22-18-15(10-13(26(30)31)11-17(18)27(32)33)20(28)24-25-19(12-6-2-1-3-7-12)23-16-9-5-4-8-14(16)21(25)29/h4-5,8-12H,1-3,6-7H2,(H,24,28)