N-(2,6-dimethyl-3-propan-2-yl-phenyl)-9-nitro-imidazo[1,5-a]quinoxalin-4-amine

Systemtic Name: N-(2,6-dimethyl-3-propan-2-yl-phenyl)-9-nitro-imidazo[1,5-a]quinoxalin-4-amine Openeye Name: N-(3-isopropyl-2,6-dimethyl-phenyl)-9-nitro-imidazo[1,5-a]quinoxalin-4-amine CAS Name: N-(2,6-dimethyl-3-propan-2-ylphenyl)-9-nitro-4-imidazo[1,5-a]quinoxalinamine IUPAC Name: N-(2,6-dimethyl-3-propan-2-ylphenyl)-9-nitroimidazo[1,5-a]quinoxalin-4-amine Traditional Name: (3-isopropyl-2,6-dimethyl-phenyl)-(9-nitroimidazo[1,5-a]quinoxalin-4-yl)amine Formula: C21H21N5O2 MolecularWeight: 375.42374

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)C(C)C)C)NC2=NC3=C(C(=CC=C3)[N+](=O)[O-])N4C2=CN=C4

Isomeric SMILES

CC1=C(C(=C(C=C1)C(C)C)C)NC2=NC3=C(C(=CC=C3)[N+](=O)[O-])N4C2=CN=C4

InChI

InChI=1S/C21H21N5O2/c1-12(2)15-9-8-13(3)19(14(15)4)24-21-18-10-22-11-25(18)20-16(23-21)6-5-7-17(20)26(27)28/h5-12H,1-4H3,(H,23,24)