3-[3-methyl-6-[4-(2-oxidanylidenepiperidin-1-yl)phenyl]indazol-1-yl]benzenecarbonitrile

Systemtic Name: 3-[3-methyl-6-[4-(2-oxidanylidenepiperidin-1-yl)phenyl]indazol-1-yl]benzenecarbonitrile Openeye Name: 3-[3-methyl-6-[4-(2-oxo-1-piperidyl)phenyl]indazol-1-yl]benzonitrile CAS Name: 3-[3-methyl-6-[4-(2-oxo-1-piperidinyl)phenyl]-1-indazolyl]benzonitrile IUPAC Name: 3-[3-methyl-6-[4-(2-oxopiperidin-1-yl)phenyl]indazol-1-yl]benzonitrile Traditional Name: 3-[6-[4-(2-ketopiperidino)phenyl]-3-methyl-indazol-1-yl]benzonitrile Formula: C26H22N4O MolecularWeight: 406.47908

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C=CC(=C2)C3=CC=C(C=C3)N4CCCCC4=O)C5=CC=CC(=C5)C#N

Isomeric SMILES

CC1=NN(C2=C1C=CC(=C2)C3=CC=C(C=C3)N4CCCCC4=O)C5=CC=CC(=C5)C#N

InChI

InChI=1S/C26H22N4O/c1-18-24-13-10-21(16-25(24)30(28-18)23-6-4-5-19(15-23)17-27)20-8-11-22(12-9-20)29-14-3-2-7-26(29)31/h4-6,8-13,15-16H,2-3,7,14H2,1H3