2-[(3-nitro-4-propan-2-yl-phenyl)methylideneamino]-1-(2,3,4-trimethoxyphenyl)ethanone

Systemtic Name: 2-[(3-nitro-4-propan-2-yl-phenyl)methylideneamino]-1-(2,3,4-trimethoxyphenyl)ethanone Openeye Name: 2-[(4-isopropyl-3-nitro-phenyl)methyleneamino]-1-(2,3,4-trimethoxyphenyl)ethanone CAS Name: 2-[(3-nitro-4-propan-2-ylphenyl)methylideneamino]-1-(2,3,4-trimethoxyphenyl)ethanone IUPAC Name: 2-[(3-nitro-4-propan-2-ylphenyl)methylideneamino]-1-(2,3,4-trimethoxyphenyl)ethanone Traditional Name: 2-[(4-isopropyl-3-nitro-benzylidene)amino]-1-(2,3,4-trimethoxyphenyl)ethanone Formula: C21H24N2O6 MolecularWeight: 400.42506

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C=C(C=C1)C=NCC(=O)C2=C(C(=C(C=C2)OC)OC)OC)[N+](=O)[O-]

Isomeric SMILES

CC(C)C1=C(C=C(C=C1)C=NCC(=O)C2=C(C(=C(C=C2)OC)OC)OC)[N+](=O)[O-]

InChI

InChI=1S/C21H24N2O6/c1-13(2)15-7-6-14(10-17(15)23(25)26)11-22-12-18(24)16-8-9-19(27-3)21(29-5)20(16)28-4/h6-11,13H,12H2,1-5H3