N-(1-adamantylmethyl)-3-bromanyl-4-ethoxy-5-methoxy-N-methyl-benzamide

Systemtic Name: N-(1-adamantylmethyl)-3-bromanyl-4-ethoxy-5-methoxy-N-methyl-benzamide Openeye Name: N-(1-adamantylmethyl)-3-bromo-4-ethoxy-5-methoxy-N-methyl-benzamide CAS Name: N-(1-adamantylmethyl)-3-bromo-4-ethoxy-5-methoxy-N-methylbenzamide IUPAC Name: N-(1-adamantylmethyl)-3-bromo-4-ethoxy-5-methoxy-N-methylbenzamide Traditional Name: N-(1-adamantylmethyl)-3-bromo-4-ethoxy-5-methoxy-N-methyl-benzamide Formula: C22H30BrNO3 MolecularWeight: 436.3825

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1Br)C(=O)N(C)CC23CC4CC(C2)CC(C4)C3)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1Br)C(=O)N(C)CC23CC4CC(C2)CC(C4)C3)OC

InChI

InChI=1S/C22H30BrNO3/c1-4-27-20-18(23)8-17(9-19(20)26-3)21(25)24(2)13-22-10-14-5-15(11-22)7-16(6-14)12-22/h8-9,14-16H,4-7,10-13H2,1-3H3