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

Systemtic Name: 2-chloranyl-N-[cycloheptyl(oxidanyl)methyl]-5-(5-methyl-3-oxidanylidene-1H-1,2,4-triazol-2-yl)benzamide Openeye Name: 2-chloro-N-[cycloheptyl(hydroxy)methyl]-5-(5-methyl-3-oxo-1H-1,2,4-triazol-2-yl)benzamide CAS Name: 2-chloro-N-[cycloheptyl(hydroxy)methyl]-5-(5-methyl-3-oxo-1H-1,2,4-triazol-2-yl)benzamide IUPAC Name: 2-chloro-N-[cycloheptyl(hydroxy)methyl]-5-(5-methyl-3-oxo-1H-1,2,4-triazol-2-yl)benzamide Traditional Name: 2-chloro-N-[cycloheptyl(hydroxy)methyl]-5-(3-keto-5-methyl-1H-1,2,4-triazol-2-yl)benzamide Formula: C18H23ClN4O3 MolecularWeight: 378.85322

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=O)N(N1)C2=CC(=C(C=C2)Cl)C(=O)NC(C3CCCCCC3)O

Isomeric SMILES

CC1=NC(=O)N(N1)C2=CC(=C(C=C2)Cl)C(=O)NC(C3CCCCCC3)O

InChI

InChI=1S/C18H23ClN4O3/c1-11-20-18(26)23(22-11)13-8-9-15(19)14(10-13)17(25)21-16(24)12-6-4-2-3-5-7-12/h8-10,12,16,24H,2-7H2,1H3,(H,21,25)(H,20,22,26)