1-[4-(4-azanylimidazo[4,5-c]quinolin-1-yl)butyl]-3-(4-nitrophenyl)urea

Systemtic Name: 1-[4-(4-azanylimidazo[4,5-c]quinolin-1-yl)butyl]-3-(4-nitrophenyl)urea Openeye Name: 1-[4-(4-aminoimidazo[4,5-c]quinolin-1-yl)butyl]-3-(4-nitrophenyl)urea CAS Name: 1-[4-(4-amino-1-imidazo[4,5-c]quinolinyl)butyl]-3-(4-nitrophenyl)urea IUPAC Name: 1-[4-(4-aminoimidazo[4,5-c]quinolin-1-yl)butyl]-3-(4-nitrophenyl)urea Traditional Name: 1-[4-(4-aminoimidazo[4,5-c]quinolin-1-yl)butyl]-3-(4-nitrophenyl)urea Formula: C21H21N7O3 MolecularWeight: 419.43654

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C3=C(C(=N2)N)N=CN3CCCCNC(=O)NC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C3=C(C(=N2)N)N=CN3CCCCNC(=O)NC4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H21N7O3/c22-20-18-19(16-5-1-2-6-17(16)26-20)27(13-24-18)12-4-3-11-23-21(29)25-14-7-9-15(10-8-14)28(30)31/h1-2,5-10,13H,3-4,11-12H2,(H2,22,26)(H2,23,25,29)