N-[[5-chloranyl-3-methyl-1-[3-(trifluoromethyl)phenyl]pyrazol-4-yl]methylideneamino]-3-nitro-aniline

Systemtic Name: N-[[5-chloranyl-3-methyl-1-[3-(trifluoromethyl)phenyl]pyrazol-4-yl]methylideneamino]-3-nitro-aniline Openeye Name: N-[[5-chloro-3-methyl-1-[3-(trifluoromethyl)phenyl]pyrazol-4-yl]methyleneamino]-3-nitro-aniline CAS Name: N-[[5-chloro-3-methyl-1-[3-(trifluoromethyl)phenyl]-4-pyrazolyl]methylideneamino]-3-nitroaniline IUPAC Name: N-[[5-chloro-3-methyl-1-[3-(trifluoromethyl)phenyl]pyrazol-4-yl]methylideneamino]-3-nitroaniline Traditional Name: [[5-chloro-3-methyl-1-[3-(trifluoromethyl)phenyl]pyrazol-4-yl]methyleneamino]-(3-nitrophenyl)amine Formula: C18H13ClF3N5O2 MolecularWeight: 423.77633

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C=NNC2=CC(=CC=C2)[N+](=O)[O-])Cl)C3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

CC1=NN(C(=C1C=NNC2=CC(=CC=C2)[N+](=O)[O-])Cl)C3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C18H13ClF3N5O2/c1-11-16(10-23-24-13-5-3-7-15(9-13)27(28)29)17(19)26(25-11)14-6-2-4-12(8-14)18(20,21)22/h2-10,24H,1H3