N-[(5-fluoranyl-2-methyl-4-pyrrolidin-1-yl-phenyl)methylideneamino]-2,4-dinitro-aniline

Systemtic Name: N-[(5-fluoranyl-2-methyl-4-pyrrolidin-1-yl-phenyl)methylideneamino]-2,4-dinitro-aniline Openeye Name: N-[(5-fluoro-2-methyl-4-pyrrolidin-1-yl-phenyl)methyleneamino]-2,4-dinitro-aniline CAS Name: N-[[5-fluoro-2-methyl-4-(1-pyrrolidinyl)phenyl]methylideneamino]-2,4-dinitroaniline IUPAC Name: N-[(5-fluoro-2-methyl-4-pyrrolidin-1-ylphenyl)methylideneamino]-2,4-dinitroaniline Traditional Name: (2,4-dinitrophenyl)-[(5-fluoro-2-methyl-4-pyrrolidino-benzylidene)amino]amine Formula: C18H18FN5O4 MolecularWeight: 387.365023

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C=NNC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])F)N3CCCC3

Isomeric SMILES

CC1=CC(=C(C=C1C=NNC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])F)N3CCCC3

InChI

InChI=1S/C18H18FN5O4/c1-12-8-17(22-6-2-3-7-22)15(19)9-13(12)11-20-21-16-5-4-14(23(25)26)10-18(16)24(27)28/h4-5,8-11,21H,2-3,6-7H2,1H3