2-[3-(1,2,3,4-tetrazol-2-yl)-1-adamantyl]ethanoic acid

Systemtic Name: 2-[3-(1,2,3,4-tetrazol-2-yl)-1-adamantyl]ethanoic acid Openeye Name: 2-[3-(tetrazol-2-yl)-1-adamantyl]acetic acid CAS Name: 2-[3-(2-tetrazolyl)-1-adamantyl]acetic acid IUPAC Name: 2-[3-(tetrazol-2-yl)-1-adamantyl]acetic acid Traditional Name: 2-[3-(tetrazol-2-yl)-1-adamantyl]acetic acid Formula: C13H18N4O2 MolecularWeight: 262.30762

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3(CC1CC(C2)(C3)N4N=CN=N4)CC(=O)O

Isomeric SMILES

C1C2CC3(CC1CC(C2)(C3)N4N=CN=N4)CC(=O)O

InChI

InChI=1S/C13H18N4O2/c18-11(19)6-12-2-9-1-10(3-12)5-13(4-9,7-12)17-15-8-14-16-17/h8-10H,1-7H2,(H,18,19)