(E)-3-(4-chloranyl-3-nitro-phenyl)-N-[6-methyl-2-(4-methylphenyl)benzotriazol-5-yl]prop-2-enamide

Systemtic Name: (E)-3-(4-chloranyl-3-nitro-phenyl)-N-[6-methyl-2-(4-methylphenyl)benzotriazol-5-yl]prop-2-enamide Openeye Name: (E)-3-(4-chloro-3-nitro-phenyl)-N-[6-methyl-2-(p-tolyl)benzotriazol-5-yl]prop-2-enamide CAS Name: (E)-3-(4-chloro-3-nitrophenyl)-N-[6-methyl-2-(4-methylphenyl)-5-benzotriazolyl]-2-propenamide IUPAC Name: (E)-3-(4-chloro-3-nitrophenyl)-N-[6-methyl-2-(4-methylphenyl)benzotriazol-5-yl]prop-2-enamide Traditional Name: (E)-3-(4-chloro-3-nitro-phenyl)-N-[6-methyl-2-(p-tolyl)benzotriazol-5-yl]acrylamide Formula: C23H18ClN5O3 MolecularWeight: 447.87372

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2N=C3C=C(C(=CC3=N2)NC(=O)C=CC4=CC(=C(C=C4)Cl)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC=C(C=C1)N2N=C3C=C(C(=CC3=N2)NC(=O)/C=C/C4=CC(=C(C=C4)Cl)[N+](=O)[O-])C

InChI

InChI=1S/C23H18ClN5O3/c1-14-3-7-17(8-4-14)28-26-20-11-15(2)19(13-21(20)27-28)25-23(30)10-6-16-5-9-18(24)22(12-16)29(31)32/h3-13H,1-2H3,(H,25,30)/b10-6+