8-methoxy-2-[(4-phenylpiperazin-1-ium-1-yl)methyl]quinoline

Systemtic Name: 8-methoxy-2-[(4-phenylpiperazin-1-ium-1-yl)methyl]quinoline Openeye Name: 8-methoxy-2-[(4-phenylpiperazin-1-ium-1-yl)methyl]quinoline CAS Name: 8-methoxy-2-[(4-phenyl-1-piperazin-1-iumyl)methyl]quinoline IUPAC Name: 8-methoxy-2-[(4-phenylpiperazin-1-ium-1-yl)methyl]quinoline Traditional Name: 8-methoxy-2-[(4-phenylpiperazin-1-ium-1-yl)methyl]quinoline Formula: C21H24N3O+ MolecularWeight: 334.43476

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC2=C1N=C(C=C2)C[NH+]3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

COC1=CC=CC2=C1N=C(C=C2)C[NH+]3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C21H23N3O/c1-25-20-9-5-6-17-10-11-18(22-21(17)20)16-23-12-14-24(15-13-23)19-7-3-2-4-8-19/h2-11H,12-16H2,1H3/p+1