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

Systemtic Name: 2-[[2-(furan-2-yl)-2-pyrrolidin-1-yl-ethyl]amino]-5-nitro-benzenecarbonitrile Openeye Name: 2-[[2-(2-furyl)-2-pyrrolidin-1-yl-ethyl]amino]-5-nitro-benzonitrile CAS Name: 2-[[2-(2-furanyl)-2-(1-pyrrolidinyl)ethyl]amino]-5-nitrobenzonitrile IUPAC Name: 2-[[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]amino]-5-nitrobenzonitrile Traditional Name: 2-[[2-(2-furyl)-2-pyrrolidino-ethyl]amino]-5-nitro-benzonitrile Formula: C17H18N4O3 MolecularWeight: 326.34982

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(CNC2=C(C=C(C=C2)[N+](=O)[O-])C#N)C3=CC=CO3

Isomeric SMILES

C1CCN(C1)C(CNC2=C(C=C(C=C2)[N+](=O)[O-])C#N)C3=CC=CO3

InChI

InChI=1S/C17H18N4O3/c18-11-13-10-14(21(22)23)5-6-15(13)19-12-16(17-4-3-9-24-17)20-7-1-2-8-20/h3-6,9-10,16,19H,1-2,7-8,12H2