2-azanyl-1-(4-chloranyl-3-nitro-phenyl)-N-hexyl-pyrrolo[3,2-b]quinoxaline-3-carboxamide

Systemtic Name: 2-azanyl-1-(4-chloranyl-3-nitro-phenyl)-N-hexyl-pyrrolo[3,2-b]quinoxaline-3-carboxamide Openeye Name: 2-amino-1-(4-chloro-3-nitro-phenyl)-N-hexyl-pyrrolo[3,2-b]quinoxaline-3-carboxamide CAS Name: 2-amino-1-(4-chloro-3-nitrophenyl)-N-hexyl-3-pyrrolo[3,2-b]quinoxalinecarboxamide IUPAC Name: 2-amino-1-(4-chloro-3-nitrophenyl)-N-hexylpyrrolo[3,2-b]quinoxaline-3-carboxamide Traditional Name: 2-amino-1-(4-chloro-3-nitro-phenyl)-N-hexyl-pyrrolo[3,2-b]quinoxaline-3-carboxamide Formula: C23H23ClN6O3 MolecularWeight: 466.92012

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)C4=CC(=C(C=C4)Cl)[N+](=O)[O-])N

Isomeric SMILES

CCCCCCNC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)C4=CC(=C(C=C4)Cl)[N+](=O)[O-])N

InChI

InChI=1S/C23H23ClN6O3/c1-2-3-4-7-12-26-23(31)19-20-22(28-17-9-6-5-8-16(17)27-20)29(21(19)25)14-10-11-15(24)18(13-14)30(32)33/h5-6,8-11,13H,2-4,7,12,25H2,1H3,(H,26,31)