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tert-butyl 4-[3-(dicyanomethyl)pyrrolidin-1-yl]benzoate

tert-butyl 4-[3-(dicyanomethyl)pyrrolidin-1-yl]benzoate

Systemtic Name:tert-butyl 4-[3-(dicyanomethyl)pyrrolidin-1-yl]benzoate
Openeye Name:tert-butyl 4-[3-(dicyanomethyl)pyrrolidin-1-yl]benzoate
CAS Name:4-[3-(dicyanomethyl)-1-pyrrolidinyl]benzoic acid tert-butyl ester
IUPAC Name:tert-butyl 4-[3-(dicyanomethyl)pyrrolidin-1-yl]benzoate
Traditional Name:4-[3-(dicyanomethyl)pyrrolidino]benzoic acid tert-butyl ester
Formula: C18H21N3O2
MolecularWeight: 311.37824
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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1=CC=C(C=C1)N2CCC(C2)C(C#N)C#N


Isomeric SMILES

CC(C)(C)OC(=O)C1=CC=C(C=C1)N2CCC(C2)C(C#N)C#N


InChI

InChI=1S/C18H21N3O2/c1-18(2,3)23-17(22)13-4-6-16(7-5-13)21-9-8-14(12-21)15(10-19)11-20/h4-7,14-15H,8-9,12H2,1-3H3


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