4-[[2-(5-methylfuran-2-yl)-2-morpholin-4-yl-ethyl]amino]-3-nitro-benzenecarbonitrile

Systemtic Name: 4-[[2-(5-methylfuran-2-yl)-2-morpholin-4-yl-ethyl]amino]-3-nitro-benzenecarbonitrile Openeye Name: 4-[[2-(5-methyl-2-furyl)-2-morpholino-ethyl]amino]-3-nitro-benzonitrile CAS Name: 4-[[2-(5-methyl-2-furanyl)-2-(4-morpholinyl)ethyl]amino]-3-nitrobenzonitrile IUPAC Name: 4-[[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]amino]-3-nitrobenzonitrile Traditional Name: 4-[[2-(5-methyl-2-furyl)-2-morpholino-ethyl]amino]-3-nitro-benzonitrile Formula: C18H20N4O4 MolecularWeight: 356.3758

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)C(CNC2=C(C=C(C=C2)C#N)[N+](=O)[O-])N3CCOCC3

Isomeric SMILES

CC1=CC=C(O1)C(CNC2=C(C=C(C=C2)C#N)[N+](=O)[O-])N3CCOCC3

InChI

InChI=1S/C18H20N4O4/c1-13-2-5-18(26-13)17(21-6-8-25-9-7-21)12-20-15-4-3-14(11-19)10-16(15)22(23)24/h2-5,10,17,20H,6-9,12H2,1H3