N-(2-adamantyl)-1-[(4-methoxyphenoxy)methyl]pyrazole-3-carboxamide

Systemtic Name: N-(2-adamantyl)-1-[(4-methoxyphenoxy)methyl]pyrazole-3-carboxamide Openeye Name: N-(2-adamantyl)-1-[(4-methoxyphenoxy)methyl]pyrazole-3-carboxamide CAS Name: N-(2-adamantyl)-1-[(4-methoxyphenoxy)methyl]-3-pyrazolecarboxamide IUPAC Name: N-(2-adamantyl)-1-[(4-methoxyphenoxy)methyl]pyrazole-3-carboxamide Traditional Name: N-(2-adamantyl)-1-[(4-methoxyphenoxy)methyl]pyrazole-3-carboxamide Formula: C22H27N3O3 MolecularWeight: 381.46808

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)OCN2C=CC(=N2)C(=O)NC3C4CC5CC(C4)CC3C5

Isomeric SMILES

COC1=CC=C(C=C1)OCN2C=CC(=N2)C(=O)NC3C4CC5CC(C4)CC3C5

InChI

InChI=1S/C22H27N3O3/c1-27-18-2-4-19(5-3-18)28-13-25-7-6-20(24-25)22(26)23-21-16-9-14-8-15(11-16)12-17(21)10-14/h2-7,14-17,21H,8-13H2,1H3,(H,23,26)