2-piperazin-4-ium-1-yl-6-propan-2-yloxy-quinoline-3-carbonitrile

Systemtic Name: 2-piperazin-4-ium-1-yl-6-propan-2-yloxy-quinoline-3-carbonitrile Openeye Name: 6-isopropoxy-2-piperazin-4-ium-1-yl-quinoline-3-carbonitrile CAS Name: 2-(1-piperazin-4-iumyl)-6-propan-2-yloxy-3-quinolinecarbonitrile IUPAC Name: 2-piperazin-4-ium-1-yl-6-propan-2-yloxyquinoline-3-carbonitrile Traditional Name: 6-isopropoxy-2-piperazin-4-ium-1-yl-quinoline-3-carbonitrile Formula: C17H21N4O+ MolecularWeight: 297.37484

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC2=C(C=C1)N=C(C(=C2)C#N)N3CC[NH2+]CC3

Isomeric SMILES

CC(C)OC1=CC2=C(C=C1)N=C(C(=C2)C#N)N3CC[NH2+]CC3

InChI

InChI=1S/C17H20N4O/c1-12(2)22-15-3-4-16-13(10-15)9-14(11-18)17(20-16)21-7-5-19-6-8-21/h3-4,9-10,12,19H,5-8H2,1-2H3/p+1