4-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-3-nitro-benzenecarbonitrile

Systemtic Name: 4-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-3-nitro-benzenecarbonitrile Openeye Name: 4-[(2,2-dimethyl-3H-benzofuran-7-yl)oxy]-3-nitro-benzonitrile CAS Name: 4-[(2,2-dimethyl-3H-benzofuran-7-yl)oxy]-3-nitrobenzonitrile IUPAC Name: 4-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-3-nitrobenzonitrile Traditional Name: 4-(2,2-dimethylcoumaran-7-yl)oxy-3-nitro-benzonitrile Formula: C17H14N2O4 MolecularWeight: 310.30406

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(O1)C(=CC=C2)OC3=C(C=C(C=C3)C#N)[N+](=O)[O-])C

Isomeric SMILES

CC1(CC2=C(O1)C(=CC=C2)OC3=C(C=C(C=C3)C#N)[N+](=O)[O-])C

InChI

InChI=1S/C17H14N2O4/c1-17(2)9-12-4-3-5-15(16(12)23-17)22-14-7-6-11(10-18)8-13(14)19(20)21/h3-8H,9H2,1-2H3