3-methyl-4-(4-morpholin-4-yl-3-nitro-phenyl)-4-oxidanylidene-butanenitrile

Systemtic Name: 3-methyl-4-(4-morpholin-4-yl-3-nitro-phenyl)-4-oxidanylidene-butanenitrile Openeye Name: 3-methyl-4-(4-morpholino-3-nitro-phenyl)-4-oxo-butanenitrile CAS Name: 3-methyl-4-[4-(4-morpholinyl)-3-nitrophenyl]-4-oxobutanenitrile IUPAC Name: 3-methyl-4-(4-morpholin-4-yl-3-nitrophenyl)-4-oxobutanenitrile Traditional Name: 4-keto-3-methyl-4-(4-morpholino-3-nitro-phenyl)butyronitrile Formula: C15H17N3O4 MolecularWeight: 303.31318

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC#N)C(=O)C1=CC(=C(C=C1)N2CCOCC2)[N+](=O)[O-]

Isomeric SMILES

CC(CC#N)C(=O)C1=CC(=C(C=C1)N2CCOCC2)[N+](=O)[O-]

InChI

InChI=1S/C15H17N3O4/c1-11(4-5-16)15(19)12-2-3-13(14(10-12)18(20)21)17-6-8-22-9-7-17/h2-3,10-11H,4,6-9H2,1H3