N-(2-cyclohexyl-4-oxidanylidene-quinazolin-3-yl)-3-methyl-4-nitro-benzamide

Systemtic Name: N-(2-cyclohexyl-4-oxidanylidene-quinazolin-3-yl)-3-methyl-4-nitro-benzamide Openeye Name: N-(2-cyclohexyl-4-oxo-quinazolin-3-yl)-3-methyl-4-nitro-benzamide CAS Name: N-(2-cyclohexyl-4-oxo-3-quinazolinyl)-3-methyl-4-nitrobenzamide IUPAC Name: N-(2-cyclohexyl-4-oxoquinazolin-3-yl)-3-methyl-4-nitrobenzamide Traditional Name: N-(2-cyclohexyl-4-keto-quinazolin-3-yl)-3-methyl-4-nitro-benzamide Formula: C22H22N4O4 MolecularWeight: 406.43448

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)NN2C(=NC3=CC=CC=C3C2=O)C4CCCCC4)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)NN2C(=NC3=CC=CC=C3C2=O)C4CCCCC4)[N+](=O)[O-]

InChI

InChI=1S/C22H22N4O4/c1-14-13-16(11-12-19(14)26(29)30)21(27)24-25-20(15-7-3-2-4-8-15)23-18-10-6-5-9-17(18)22(25)28/h5-6,9-13,15H,2-4,7-8H2,1H3,(H,24,27)