2-chloranyl-N-[2-(4-ethoxyphenyl)-6-methyl-benzotriazol-5-yl]pyridine-3-carboxamide

Systemtic Name: 2-chloranyl-N-[2-(4-ethoxyphenyl)-6-methyl-benzotriazol-5-yl]pyridine-3-carboxamide Openeye Name: 2-chloro-N-[2-(4-ethoxyphenyl)-6-methyl-benzotriazol-5-yl]pyridine-3-carboxamide CAS Name: 2-chloro-N-[2-(4-ethoxyphenyl)-6-methyl-5-benzotriazolyl]-3-pyridinecarboxamide IUPAC Name: 2-chloro-N-[2-(4-ethoxyphenyl)-6-methylbenzotriazol-5-yl]pyridine-3-carboxamide Traditional Name: 2-chloro-N-(6-methyl-2-p-phenetyl-benzotriazol-5-yl)nicotinamide Formula: C21H18ClN5O2 MolecularWeight: 407.85292

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H18ClN5O2/c1-3-29-15-8-6-14(7-9-15)27-25-18-11-13(2)17(12-19(18)26-27)24-21(28)16-5-4-10-23-20(16)22/h4-12H,3H2,1-2H3,(H,24,28)