1-[4-(4-azanylimidazo[4,5-c]quinolin-1-yl)butyl]-3-(2-nitrophenyl)urea

Systemtic Name: 1-[4-(4-azanylimidazo[4,5-c]quinolin-1-yl)butyl]-3-(2-nitrophenyl)urea Openeye Name: 1-[4-(4-aminoimidazo[4,5-c]quinolin-1-yl)butyl]-3-(2-nitrophenyl)urea CAS Name: 1-[4-(4-amino-1-imidazo[4,5-c]quinolinyl)butyl]-3-(2-nitrophenyl)urea IUPAC Name: 1-[4-(4-aminoimidazo[4,5-c]quinolin-1-yl)butyl]-3-(2-nitrophenyl)urea Traditional Name: 1-[4-(4-aminoimidazo[4,5-c]quinolin-1-yl)butyl]-3-(2-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=CC=C4[N+](=O)[O-]

Isomeric SMILES

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

InChI

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