6-azanyl-2-(4-piperidin-1-ylphenyl)benzotriazole-4-carbonitrile

Systemtic Name: 6-azanyl-2-(4-piperidin-1-ylphenyl)benzotriazole-4-carbonitrile Openeye Name: 6-amino-2-[4-(1-piperidyl)phenyl]benzotriazole-4-carbonitrile CAS Name: 6-amino-2-[4-(1-piperidinyl)phenyl]-4-benzotriazolecarbonitrile IUPAC Name: 6-amino-2-(4-piperidin-1-ylphenyl)benzotriazole-4-carbonitrile Traditional Name: 6-amino-2-(4-piperidinophenyl)benzotriazole-4-carbonitrile Formula: C18H18N6 MolecularWeight: 318.37572

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=CC=C(C=C2)N3N=C4C=C(C=C(C4=N3)C#N)N

Isomeric SMILES

C1CCN(CC1)C2=CC=C(C=C2)N3N=C4C=C(C=C(C4=N3)C#N)N

InChI

InChI=1S/C18H18N6/c19-12-13-10-14(20)11-17-18(13)22-24(21-17)16-6-4-15(5-7-16)23-8-2-1-3-9-23/h4-7,10-11H,1-3,8-9,20H2