4-chloranyl-N-[2-(4-fluorophenyl)-6-methyl-benzotriazol-5-yl]-3-nitro-benzamide

Systemtic Name: 4-chloranyl-N-[2-(4-fluorophenyl)-6-methyl-benzotriazol-5-yl]-3-nitro-benzamide Openeye Name: 4-chloro-N-[2-(4-fluorophenyl)-6-methyl-benzotriazol-5-yl]-3-nitro-benzamide CAS Name: 4-chloro-N-[2-(4-fluorophenyl)-6-methyl-5-benzotriazolyl]-3-nitrobenzamide IUPAC Name: 4-chloro-N-[2-(4-fluorophenyl)-6-methylbenzotriazol-5-yl]-3-nitrobenzamide Traditional Name: 4-chloro-N-[2-(4-fluorophenyl)-6-methyl-benzotriazol-5-yl]-3-nitro-benzamide Formula: C20H13ClFN5O3 MolecularWeight: 425.800323

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=NN(N=C2C=C1NC(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-])C4=CC=C(C=C4)F

Isomeric SMILES

CC1=CC2=NN(N=C2C=C1NC(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-])C4=CC=C(C=C4)F

InChI

InChI=1S/C20H13ClFN5O3/c1-11-8-17-18(25-26(24-17)14-5-3-13(22)4-6-14)10-16(11)23-20(28)12-2-7-15(21)19(9-12)27(29)30/h2-10H,1H3,(H,23,28)