N-(1-adamantylmethyl)-N-(2-hydroxyethyl)-1-[(E)-3-phenylprop-2-enyl]-1,2,3-triazole-4-carboxamide

Systemtic Name: N-(1-adamantylmethyl)-N-(2-hydroxyethyl)-1-[(E)-3-phenylprop-2-enyl]-1,2,3-triazole-4-carboxamide Openeye Name: N-(1-adamantylmethyl)-1-[(E)-cinnamyl]-N-(2-hydroxyethyl)triazole-4-carboxamide CAS Name: N-(1-adamantylmethyl)-N-(2-hydroxyethyl)-1-[(E)-3-phenylprop-2-enyl]-4-triazolecarboxamide IUPAC Name: N-(1-adamantylmethyl)-N-(2-hydroxyethyl)-1-[(E)-3-phenylprop-2-enyl]triazole-4-carboxamide Traditional Name: N-(1-adamantylmethyl)-1-[(E)-cinnamyl]-N-(2-hydroxyethyl)triazole-4-carboxamide Formula: C25H32N4O2 MolecularWeight: 420.54718

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)CN(CCO)C(=O)C4=CN(N=N4)CC=CC5=CC=CC=C5

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)CN(CCO)C(=O)C4=CN(N=N4)C/C=C/C5=CC=CC=C5

InChI

InChI=1S/C25H32N4O2/c30-10-9-28(18-25-14-20-11-21(15-25)13-22(12-20)16-25)24(31)23-17-29(27-26-23)8-4-7-19-5-2-1-3-6-19/h1-7,17,20-22,30H,8-16,18H2/b7-4+