4-[(2,5-dimethylpiperazin-1-yl)-(3-hydroxyphenyl)methyl]benzenecarbonitrile

Systemtic Name: 4-[(2,5-dimethylpiperazin-1-yl)-(3-hydroxyphenyl)methyl]benzenecarbonitrile Openeye Name: 4-[(2,5-dimethylpiperazin-1-yl)-(3-hydroxyphenyl)methyl]benzonitrile CAS Name: 4-[(2,5-dimethyl-1-piperazinyl)-(3-hydroxyphenyl)methyl]benzonitrile IUPAC Name: 4-[(2,5-dimethylpiperazin-1-yl)-(3-hydroxyphenyl)methyl]benzonitrile Traditional Name: 4-[(2,5-dimethylpiperazino)-(3-hydroxyphenyl)methyl]benzonitrile Formula: C20H23N3O MolecularWeight: 321.41612

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Descriptors Computed from Structure

Canonical SMILES:

CC1CNC(CN1C(C2=CC=C(C=C2)C#N)C3=CC(=CC=C3)O)C

Isomeric SMILES

CC1CNC(CN1C(C2=CC=C(C=C2)C#N)C3=CC(=CC=C3)O)C

InChI

InChI=1S/C20H23N3O/c1-14-13-23(15(2)12-22-14)20(18-4-3-5-19(24)10-18)17-8-6-16(11-21)7-9-17/h3-10,14-15,20,22,24H,12-13H2,1-2H3