N-[[3-methoxy-4-(3-methylbutoxy)phenyl]methylideneamino]-2-nitro-4-(trifluoromethyl)aniline

Systemtic Name: N-[[3-methoxy-4-(3-methylbutoxy)phenyl]methylideneamino]-2-nitro-4-(trifluoromethyl)aniline Openeye Name: N-[(4-isopentyloxy-3-methoxy-phenyl)methyleneamino]-2-nitro-4-(trifluoromethyl)aniline CAS Name: N-[[3-methoxy-4-(3-methylbutoxy)phenyl]methylideneamino]-2-nitro-4-(trifluoromethyl)aniline IUPAC Name: N-[[3-methoxy-4-(3-methylbutoxy)phenyl]methylideneamino]-2-nitro-4-(trifluoromethyl)aniline Traditional Name: [(4-isoamoxy-3-methoxy-benzylidene)amino]-[2-nitro-4-(trifluoromethyl)phenyl]amine Formula: C20H22F3N3O4 MolecularWeight: 425.40159

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=C(C=C(C=C1)C=NNC2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-])OC

Isomeric SMILES

CC(C)CCOC1=C(C=C(C=C1)C=NNC2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-])OC

InChI

InChI=1S/C20H22F3N3O4/c1-13(2)8-9-30-18-7-4-14(10-19(18)29-3)12-24-25-16-6-5-15(20(21,22)23)11-17(16)26(27)28/h4-7,10-13,25H,8-9H2,1-3H3