4-[[3-(furan-2-ylmethoxymethyl)phenyl]methylamino]-3-nitro-benzenecarbonitrile

Systemtic Name: 4-[[3-(furan-2-ylmethoxymethyl)phenyl]methylamino]-3-nitro-benzenecarbonitrile Openeye Name: 4-[[3-(2-furylmethoxymethyl)phenyl]methylamino]-3-nitro-benzonitrile CAS Name: 4-[[3-(2-furanylmethoxymethyl)phenyl]methylamino]-3-nitrobenzonitrile IUPAC Name: 4-[[3-(furan-2-ylmethoxymethyl)phenyl]methylamino]-3-nitrobenzonitrile Traditional Name: 4-[[3-(2-furfuryloxymethyl)benzyl]amino]-3-nitro-benzonitrile Formula: C20H17N3O4 MolecularWeight: 363.36668

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)COCC2=CC=CO2)CNC3=C(C=C(C=C3)C#N)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)COCC2=CC=CO2)CNC3=C(C=C(C=C3)C#N)[N+](=O)[O-]

InChI

InChI=1S/C20H17N3O4/c21-11-15-6-7-19(20(10-15)23(24)25)22-12-16-3-1-4-17(9-16)13-26-14-18-5-2-8-27-18/h1-10,22H,12-14H2