2-chloranyl-N-[2-(4-ethoxyphenyl)benzotriazol-5-yl]-5-nitro-benzamide

Systemtic Name: 2-chloranyl-N-[2-(4-ethoxyphenyl)benzotriazol-5-yl]-5-nitro-benzamide Openeye Name: 2-chloro-N-[2-(4-ethoxyphenyl)benzotriazol-5-yl]-5-nitro-benzamide CAS Name: 2-chloro-N-[2-(4-ethoxyphenyl)-5-benzotriazolyl]-5-nitrobenzamide IUPAC Name: 2-chloro-N-[2-(4-ethoxyphenyl)benzotriazol-5-yl]-5-nitrobenzamide Traditional Name: 2-chloro-5-nitro-N-(2-p-phenetylbenzotriazol-5-yl)benzamide Formula: C21H16ClN5O4 MolecularWeight: 437.83584

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2N=C3C=CC(=CC3=N2)NC(=O)C4=C(C=CC(=C4)[N+](=O)[O-])Cl

Isomeric SMILES

CCOC1=CC=C(C=C1)N2N=C3C=CC(=CC3=N2)NC(=O)C4=C(C=CC(=C4)[N+](=O)[O-])Cl

InChI

InChI=1S/C21H16ClN5O4/c1-2-31-16-7-4-14(5-8-16)26-24-19-10-3-13(11-20(19)25-26)23-21(28)17-12-15(27(29)30)6-9-18(17)22/h3-12H,2H2,1H3,(H,23,28)