3-chloranyl-N-[4-(1,2,3,4-tetrazol-1-yl)phenyl]adamantane-1-carboxamide

Systemtic Name: 3-chloranyl-N-[4-(1,2,3,4-tetrazol-1-yl)phenyl]adamantane-1-carboxamide Openeye Name: 3-chloro-N-[4-(tetrazol-1-yl)phenyl]adamantane-1-carboxamide CAS Name: 3-chloro-N-[4-(1-tetrazolyl)phenyl]-1-adamantanecarboxamide IUPAC Name: 3-chloro-N-[4-(tetrazol-1-yl)phenyl]adamantane-1-carboxamide Traditional Name: 3-chloro-N-[4-(tetrazol-1-yl)phenyl]adamantane-1-carboxamide Formula: C18H20ClN5O MolecularWeight: 357.8373

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3(CC1CC(C2)(C3)Cl)C(=O)NC4=CC=C(C=C4)N5C=NN=N5

Isomeric SMILES

C1C2CC3(CC1CC(C2)(C3)Cl)C(=O)NC4=CC=C(C=C4)N5C=NN=N5

InChI

InChI=1S/C18H20ClN5O/c19-18-8-12-5-13(9-18)7-17(6-12,10-18)16(25)21-14-1-3-15(4-2-14)24-11-20-22-23-24/h1-4,11-13H,5-10H2,(H,21,25)