5-nitro-2-[[2-(oxolan-3-yl)-2-pyrrolidin-1-yl-ethyl]amino]benzenecarbonitrile

Systemtic Name: 5-nitro-2-[[2-(oxolan-3-yl)-2-pyrrolidin-1-yl-ethyl]amino]benzenecarbonitrile Openeye Name: 5-nitro-2-[(2-pyrrolidin-1-yl-2-tetrahydrofuran-3-yl-ethyl)amino]benzonitrile CAS Name: 5-nitro-2-[[2-(3-oxolanyl)-2-(1-pyrrolidinyl)ethyl]amino]benzonitrile IUPAC Name: 5-nitro-2-[[2-(oxolan-3-yl)-2-pyrrolidin-1-ylethyl]amino]benzonitrile Traditional Name: 5-nitro-2-[(2-pyrrolidino-2-tetrahydrofuran-3-yl-ethyl)amino]benzonitrile Formula: C17H22N4O3 MolecularWeight: 330.38158

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(CNC2=C(C=C(C=C2)[N+](=O)[O-])C#N)C3CCOC3

Isomeric SMILES

C1CCN(C1)C(CNC2=C(C=C(C=C2)[N+](=O)[O-])C#N)C3CCOC3

InChI

InChI=1S/C17H22N4O3/c18-10-14-9-15(21(22)23)3-4-16(14)19-11-17(13-5-8-24-12-13)20-6-1-2-7-20/h3-4,9,13,17,19H,1-2,5-8,11-12H2