1-[5-[(6-bromanyl-1,3-benzodioxol-5-yl)oxymethyl]pyrrolidin-2-yl]carbonylpyrrolidine-2-carbonitrile

Systemtic Name: 1-[5-[(6-bromanyl-1,3-benzodioxol-5-yl)oxymethyl]pyrrolidin-2-yl]carbonylpyrrolidine-2-carbonitrile Openeye Name: 1-[5-[(6-bromo-1,3-benzodioxol-5-yl)oxymethyl]pyrrolidine-2-carbonyl]pyrrolidine-2-carbonitrile CAS Name: 1-[[5-[(6-bromo-1,3-benzodioxol-5-yl)oxymethyl]-2-pyrrolidinyl]-oxomethyl]-2-pyrrolidinecarbonitrile IUPAC Name: 1-[5-[(6-bromo-1,3-benzodioxol-5-yl)oxymethyl]pyrrolidine-2-carbonyl]pyrrolidine-2-carbonitrile Traditional Name: 1-[5-[(6-bromo-1,3-benzodioxol-5-yl)oxymethyl]prolyl]pyrrolidine-2-carbonitrile Formula: C18H20BrN3O4 MolecularWeight: 422.2731

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C2CCC(N2)COC3=C(C=C4C(=C3)OCO4)Br)C#N

Isomeric SMILES

C1CC(N(C1)C(=O)C2CCC(N2)COC3=C(C=C4C(=C3)OCO4)Br)C#N

InChI

InChI=1S/C18H20BrN3O4/c19-13-6-16-17(26-10-25-16)7-15(13)24-9-11-3-4-14(21-11)18(23)22-5-1-2-12(22)8-20/h6-7,11-12,14,21H,1-5,9-10H2