(2R)-4-[4-(1-adamantylcarbonylamino)butanoyl]-N-methyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide

Systemtic Name: (2R)-4-[4-(1-adamantylcarbonylamino)butanoyl]-N-methyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide Openeye Name: (2R)-4-[4-(adamantane-1-carbonylamino)butanoyl]-N-methyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide CAS Name: (2R)-4-[4-[[1-adamantyl(oxo)methyl]amino]-1-oxobutyl]-N-methyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide IUPAC Name: (2R)-4-[4-(adamantane-1-carbonylamino)butanoyl]-N-methyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide Traditional Name: (2R)-4-[4-(adamantane-1-carbonylamino)butanoyl]-N-methyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide Formula: C25H33N3O4 MolecularWeight: 439.54722

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1CN(C2=CC=CC=C2O1)C(=O)CCCNC(=O)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CNC(=O)[C@H]1CN(C2=CC=CC=C2O1)C(=O)CCCNC(=O)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C25H33N3O4/c1-26-23(30)21-15-28(19-5-2-3-6-20(19)32-21)22(29)7-4-8-27-24(31)25-12-16-9-17(13-25)11-18(10-16)14-25/h2-3,5-6,16-18,21H,4,7-15H2,1H3,(H,26,30)(H,27,31)/t16?,17?,18?,21-,25?/m1/s1