N-[4-(4-azanylimidazo[4,5-c]quinolin-1-yl)butyl]-4-phenoxy-benzamide

Systemtic Name: N-[4-(4-azanylimidazo[4,5-c]quinolin-1-yl)butyl]-4-phenoxy-benzamide Openeye Name: N-[4-(4-aminoimidazo[4,5-c]quinolin-1-yl)butyl]-4-phenoxy-benzamide CAS Name: N-[4-(4-amino-1-imidazo[4,5-c]quinolinyl)butyl]-4-phenoxybenzamide IUPAC Name: N-[4-(4-aminoimidazo[4,5-c]quinolin-1-yl)butyl]-4-phenoxybenzamide Traditional Name: N-[4-(4-aminoimidazo[4,5-c]quinolin-1-yl)butyl]-4-phenoxy-benzamide Formula: C27H25N5O2 MolecularWeight: 451.5197

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC=C(C=C2)C(=O)NCCCCN3C=NC4=C3C5=CC=CC=C5N=C4N

Isomeric SMILES

C1=CC=C(C=C1)OC2=CC=C(C=C2)C(=O)NCCCCN3C=NC4=C3C5=CC=CC=C5N=C4N

InChI

InChI=1S/C27H25N5O2/c28-26-24-25(22-10-4-5-11-23(22)31-26)32(18-30-24)17-7-6-16-29-27(33)19-12-14-21(15-13-19)34-20-8-2-1-3-9-20/h1-5,8-15,18H,6-7,16-17H2,(H2,28,31)(H,29,33)