6-[methyl-[(5-methyl-1,2-oxazol-3-yl)methyl]carbamoyl]cyclohex-3-ene-1-carboxylic acid

Systemtic Name: 6-[methyl-[(5-methyl-1,2-oxazol-3-yl)methyl]carbamoyl]cyclohex-3-ene-1-carboxylic acid Openeye Name: 6-[methyl-[(5-methylisoxazol-3-yl)methyl]carbamoyl]cyclohex-3-ene-1-carboxylic acid CAS Name: 6-[[methyl-[(5-methyl-3-isoxazolyl)methyl]amino]-oxomethyl]-1-cyclohex-3-enecarboxylic acid IUPAC Name: 6-[methyl-[(5-methyl-1,2-oxazol-3-yl)methyl]carbamoyl]cyclohex-3-ene-1-carboxylic acid Traditional Name: 6-[methyl-[(5-methylisoxazol-3-yl)methyl]carbamoyl]cyclohex-3-ene-1-carboxylic acid Formula: C14H18N2O4 MolecularWeight: 278.30372

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)CN(C)C(=O)C2CC=CCC2C(=O)O

Isomeric SMILES

CC1=CC(=NO1)CN(C)C(=O)C2CC=CCC2C(=O)O

InChI

InChI=1S/C14H18N2O4/c1-9-7-10(15-20-9)8-16(2)13(17)11-5-3-4-6-12(11)14(18)19/h3-4,7,11-12H,5-6,8H2,1-2H3,(H,18,19)