3-azanyl-5-[(Z)-1-cyano-2-(2-piperidin-1-ylquinolin-3-yl)ethenyl]-2-phenyl-1H-pyrazol-2-ium-4-carbonitrile

Systemtic Name: 3-azanyl-5-[(Z)-1-cyano-2-(2-piperidin-1-ylquinolin-3-yl)ethenyl]-2-phenyl-1H-pyrazol-2-ium-4-carbonitrile Openeye Name: 3-amino-5-[(Z)-1-cyano-2-[2-(1-piperidyl)-3-quinolyl]vinyl]-2-phenyl-1H-pyrazol-2-ium-4-carbonitrile CAS Name: 3-amino-5-[(Z)-1-cyano-2-[2-(1-piperidinyl)-3-quinolinyl]ethenyl]-2-phenyl-1H-pyrazol-2-ium-4-carbonitrile IUPAC Name: 3-amino-5-[(Z)-1-cyano-2-(2-piperidin-1-ylquinolin-3-yl)ethenyl]-2-phenyl-1H-pyrazol-2-ium-4-carbonitrile Traditional Name: 3-amino-5-[(Z)-1-cyano-2-(2-piperidino-3-quinolyl)vinyl]-2-phenyl-1H-pyrazol-2-ium-4-carbonitrile Formula: C27H24N7+ MolecularWeight: 446.52636

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=NC3=CC=CC=C3C=C2C=C(C#N)C4=C(C(=[N+](N4)C5=CC=CC=C5)N)C#N

Isomeric SMILES

C1CCN(CC1)C2=NC3=CC=CC=C3C=C2/C=C(\C#N)/C4=C(C(=[N+](N4)C5=CC=CC=C5)N)C#N

InChI

InChI=1S/C27H23N7/c28-17-21(25-23(18-29)26(30)34(32-25)22-10-3-1-4-11-22)16-20-15-19-9-5-6-12-24(19)31-27(20)33-13-7-2-8-14-33/h1,3-6,9-12,15-16H,2,7-8,13-14H2,(H2,30,32)/p+1/b21-16+