4-(6-chloranyl-1,3-benzodioxol-5-yl)-1-(phenylmethyl)pyrrolidine-3-carbonitrile

Systemtic Name: 4-(6-chloranyl-1,3-benzodioxol-5-yl)-1-(phenylmethyl)pyrrolidine-3-carbonitrile Openeye Name: 1-benzyl-4-(6-chloro-1,3-benzodioxol-5-yl)pyrrolidine-3-carbonitrile CAS Name: 4-(6-chloro-1,3-benzodioxol-5-yl)-1-(phenylmethyl)-3-pyrrolidinecarbonitrile IUPAC Name: 1-benzyl-4-(6-chloro-1,3-benzodioxol-5-yl)pyrrolidine-3-carbonitrile Traditional Name: 1-benzyl-4-(6-chloro-1,3-benzodioxol-5-yl)pyrrolidine-3-carbonitrile Formula: C19H17ClN2O2 MolecularWeight: 340.80348

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(CN1CC2=CC=CC=C2)C3=CC4=C(C=C3Cl)OCO4)C#N

Isomeric SMILES

C1C(C(CN1CC2=CC=CC=C2)C3=CC4=C(C=C3Cl)OCO4)C#N

InChI

InChI=1S/C19H17ClN2O2/c20-17-7-19-18(23-12-24-19)6-15(17)16-11-22(10-14(16)8-21)9-13-4-2-1-3-5-13/h1-7,14,16H,9-12H2