N-(1-adamantylmethyl)-5-[(3,4-dimethylphenoxy)methyl]furan-2-carboxamide

Systemtic Name: N-(1-adamantylmethyl)-5-[(3,4-dimethylphenoxy)methyl]furan-2-carboxamide Openeye Name: N-(1-adamantylmethyl)-5-[(3,4-dimethylphenoxy)methyl]furan-2-carboxamide CAS Name: N-(1-adamantylmethyl)-5-[(3,4-dimethylphenoxy)methyl]-2-furancarboxamide IUPAC Name: N-(1-adamantylmethyl)-5-[(3,4-dimethylphenoxy)methyl]furan-2-carboxamide Traditional Name: N-(1-adamantylmethyl)-5-[(3,4-dimethylphenoxy)methyl]-2-furamide Formula: C25H31NO3 MolecularWeight: 393.51854

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)OCC2=CC=C(O2)C(=O)NCC34CC5CC(C3)CC(C5)C4)C

Isomeric SMILES

CC1=C(C=C(C=C1)OCC2=CC=C(O2)C(=O)NCC34CC5CC(C3)CC(C5)C4)C

InChI

InChI=1S/C25H31NO3/c1-16-3-4-21(7-17(16)2)28-14-22-5-6-23(29-22)24(27)26-15-25-11-18-8-19(12-25)10-20(9-18)13-25/h3-7,18-20H,8-15H2,1-2H3,(H,26,27)