2-(4-fluorophenyl)-2-[4-(1-oxidanylnaphthalen-2-yl)carbonylpiperazin-1-yl]ethanenitrile

Systemtic Name: 2-(4-fluorophenyl)-2-[4-(1-oxidanylnaphthalen-2-yl)carbonylpiperazin-1-yl]ethanenitrile Openeye Name: 2-(4-fluorophenyl)-2-[4-(1-hydroxynaphthalene-2-carbonyl)piperazin-1-yl]acetonitrile CAS Name: 2-(4-fluorophenyl)-2-[4-[(1-hydroxy-2-naphthalenyl)-oxomethyl]-1-piperazinyl]acetonitrile IUPAC Name: 2-(4-fluorophenyl)-2-[4-(1-hydroxynaphthalene-2-carbonyl)piperazin-1-yl]acetonitrile Traditional Name: 2-(4-fluorophenyl)-2-[4-(1-hydroxy-2-naphthoyl)piperazino]acetonitrile Formula: C23H20FN3O2 MolecularWeight: 389.422203

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(C#N)C2=CC=C(C=C2)F)C(=O)C3=C(C4=CC=CC=C4C=C3)O

Isomeric SMILES

C1CN(CCN1C(C#N)C2=CC=C(C=C2)F)C(=O)C3=C(C4=CC=CC=C4C=C3)O

InChI

InChI=1S/C23H20FN3O2/c24-18-8-5-17(6-9-18)21(15-25)26-11-13-27(14-12-26)23(29)20-10-7-16-3-1-2-4-19(16)22(20)28/h1-10,21,28H,11-14H2