3-[4-(2-azanylquinolin-8-yl)oxypentoxy]benzenecarbonitrile

Systemtic Name: 3-[4-(2-azanylquinolin-8-yl)oxypentoxy]benzenecarbonitrile Openeye Name: 3-[4-[(2-amino-8-quinolyl)oxy]pentoxy]benzonitrile CAS Name: 3-[4-[(2-amino-8-quinolinyl)oxy]pentoxy]benzonitrile IUPAC Name: 3-[4-(2-aminoquinolin-8-yl)oxypentoxy]benzonitrile Traditional Name: 3-[4-[(2-amino-8-quinolyl)oxy]pentoxy]benzonitrile Formula: C21H21N3O2 MolecularWeight: 347.41034

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCOC1=CC=CC(=C1)C#N)OC2=CC=CC3=C2N=C(C=C3)N

Isomeric SMILES

CC(CCCOC1=CC=CC(=C1)C#N)OC2=CC=CC3=C2N=C(C=C3)N

InChI

InChI=1S/C21H21N3O2/c1-15(5-4-12-25-18-8-2-6-16(13-18)14-22)26-19-9-3-7-17-10-11-20(23)24-21(17)19/h2-3,6-11,13,15H,4-5,12H2,1H3,(H2,23,24)