4-[[4-(cyclopropylmethyl)-2,5-dimethyl-piperazin-1-yl]-(3-hydroxyphenyl)methyl]benzenecarbonitrile

Systemtic Name: 4-[[4-(cyclopropylmethyl)-2,5-dimethyl-piperazin-1-yl]-(3-hydroxyphenyl)methyl]benzenecarbonitrile Openeye Name: 4-[[4-(cyclopropylmethyl)-2,5-dimethyl-piperazin-1-yl]-(3-hydroxyphenyl)methyl]benzonitrile CAS Name: 4-[[4-(cyclopropylmethyl)-2,5-dimethyl-1-piperazinyl]-(3-hydroxyphenyl)methyl]benzonitrile IUPAC Name: 4-[[4-(cyclopropylmethyl)-2,5-dimethylpiperazin-1-yl]-(3-hydroxyphenyl)methyl]benzonitrile Traditional Name: 4-[[4-(cyclopropylmethyl)-2,5-dimethyl-piperazino]-(3-hydroxyphenyl)methyl]benzonitrile Formula: C24H29N3O MolecularWeight: 375.50656

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(C(CN1C(C2=CC=C(C=C2)C#N)C3=CC(=CC=C3)O)C)CC4CC4

Isomeric SMILES

CC1CN(C(CN1C(C2=CC=C(C=C2)C#N)C3=CC(=CC=C3)O)C)CC4CC4

InChI

InChI=1S/C24H29N3O/c1-17-15-27(18(2)14-26(17)16-20-6-7-20)24(22-4-3-5-23(28)12-22)21-10-8-19(13-25)9-11-21/h3-5,8-12,17-18,20,24,28H,6-7,14-16H2,1-2H3