(2-methoxy-5-methyl-phenyl)methyl 2-(1-adamantylcarbonylamino)ethanoate

Systemtic Name: (2-methoxy-5-methyl-phenyl)methyl 2-(1-adamantylcarbonylamino)ethanoate Openeye Name: (2-methoxy-5-methyl-phenyl)methyl 2-(adamantane-1-carbonylamino)acetate CAS Name: 2-[[1-adamantyl(oxo)methyl]amino]acetic acid (2-methoxy-5-methylphenyl)methyl ester IUPAC Name: (2-methoxy-5-methylphenyl)methyl 2-(adamantane-1-carbonylamino)acetate Traditional Name: 2-(adamantane-1-carbonylamino)acetic acid (2-methoxy-5-methyl-benzyl) ester Formula: C22H29NO4 MolecularWeight: 371.46996

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)COC(=O)CNC(=O)C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CC1=CC(=C(C=C1)OC)COC(=O)CNC(=O)C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C22H29NO4/c1-14-3-4-19(26-2)18(5-14)13-27-20(24)12-23-21(25)22-9-15-6-16(10-22)8-17(7-15)11-22/h3-5,15-17H,6-13H2,1-2H3,(H,23,25)