4-chloranyl-N-(6-methyl-2-phenyl-benzotriazol-5-yl)-3-nitro-benzamide

Systemtic Name: 4-chloranyl-N-(6-methyl-2-phenyl-benzotriazol-5-yl)-3-nitro-benzamide Openeye Name: 4-chloro-N-(6-methyl-2-phenyl-benzotriazol-5-yl)-3-nitro-benzamide CAS Name: 4-chloro-N-(6-methyl-2-phenyl-5-benzotriazolyl)-3-nitrobenzamide IUPAC Name: 4-chloro-N-(6-methyl-2-phenylbenzotriazol-5-yl)-3-nitrobenzamide Traditional Name: 4-chloro-N-(6-methyl-2-phenyl-benzotriazol-5-yl)-3-nitro-benzamide Formula: C20H14ClN5O3 MolecularWeight: 407.80986

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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=CC=C4

Isomeric SMILES

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

InChI

InChI=1S/C20H14ClN5O3/c1-12-9-17-18(24-25(23-17)14-5-3-2-4-6-14)11-16(12)22-20(27)13-7-8-15(21)19(10-13)26(28)29/h2-11H,1H3,(H,22,27)