2-chloranyl-N-[cycloheptyl(oxidanyl)methyl]-5-(5-ethyl-3-oxidanylidene-1H-1,2,4-triazol-2-yl)benzamide

Systemtic Name: 2-chloranyl-N-[cycloheptyl(oxidanyl)methyl]-5-(5-ethyl-3-oxidanylidene-1H-1,2,4-triazol-2-yl)benzamide Openeye Name: 2-chloro-N-[cycloheptyl(hydroxy)methyl]-5-(5-ethyl-3-oxo-1H-1,2,4-triazol-2-yl)benzamide CAS Name: 2-chloro-N-[cycloheptyl(hydroxy)methyl]-5-(5-ethyl-3-oxo-1H-1,2,4-triazol-2-yl)benzamide IUPAC Name: 2-chloro-N-[cycloheptyl(hydroxy)methyl]-5-(5-ethyl-3-oxo-1H-1,2,4-triazol-2-yl)benzamide Traditional Name: 2-chloro-N-[cycloheptyl(hydroxy)methyl]-5-(5-ethyl-3-keto-1H-1,2,4-triazol-2-yl)benzamide Formula: C19H25ClN4O3 MolecularWeight: 392.8798

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC(=O)N(N1)C2=CC(=C(C=C2)Cl)C(=O)NC(C3CCCCCC3)O

Isomeric SMILES

CCC1=NC(=O)N(N1)C2=CC(=C(C=C2)Cl)C(=O)NC(C3CCCCCC3)O

InChI

InChI=1S/C19H25ClN4O3/c1-2-16-21-19(27)24(23-16)13-9-10-15(20)14(11-13)18(26)22-17(25)12-7-5-3-4-6-8-12/h9-12,17,25H,2-8H2,1H3,(H,22,26)(H,21,23,27)