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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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