3-[(E)-2-[1-(2-azanylethyl)quinolin-1-ium-4-yl]ethenyl]benzenecarbonitrile

Systemtic Name: 3-[(E)-2-[1-(2-azanylethyl)quinolin-1-ium-4-yl]ethenyl]benzenecarbonitrile Openeye Name: 3-[(E)-2-[1-(2-aminoethyl)quinolin-1-ium-4-yl]vinyl]benzonitrile CAS Name: 3-[(E)-2-[1-(2-aminoethyl)-4-quinolin-1-iumyl]ethenyl]benzonitrile IUPAC Name: 3-[(E)-2-[1-(2-aminoethyl)quinolin-1-ium-4-yl]ethenyl]benzonitrile Traditional Name: 3-[(E)-2-[1-(2-aminoethyl)quinolin-1-ium-4-yl]vinyl]benzonitrile Formula: C20H18N3+ MolecularWeight: 300.37702

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC=[N+]2CCN)C=CC3=CC=CC(=C3)C#N

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC=[N+]2CCN)/C=C/C3=CC=CC(=C3)C#N

InChI

InChI=1S/C20H18N3/c21-11-13-23-12-10-18(19-6-1-2-7-20(19)23)9-8-16-4-3-5-17(14-16)15-22/h1-10,12,14H,11,13,21H2/q+1/b9-8+