2-[1-(4-methylphenyl)propylcarbamoyl]-7-oxabicyclo[2.2.1]hept-5-ene-3-carboxylic acid

Systemtic Name: 2-[1-(4-methylphenyl)propylcarbamoyl]-7-oxabicyclo[2.2.1]hept-5-ene-3-carboxylic acid Openeye Name: 2-[1-(p-tolyl)propylcarbamoyl]-7-oxabicyclo[2.2.1]hept-5-ene-3-carboxylic acid CAS Name: 2-[[1-(4-methylphenyl)propylamino]-oxomethyl]-7-oxabicyclo[2.2.1]hept-5-ene-3-carboxylic acid IUPAC Name: 2-[1-(4-methylphenyl)propylcarbamoyl]-7-oxabicyclo[2.2.1]hept-5-ene-3-carboxylic acid Traditional Name: 2-[1-(p-tolyl)propylcarbamoyl]-7-oxabicyclo[2.2.1]hept-5-ene-3-carboxylic acid Formula: C18H21NO4 MolecularWeight: 315.36364

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=C(C=C1)C)NC(=O)C2C3C=CC(C2C(=O)O)O3

Isomeric SMILES

CCC(C1=CC=C(C=C1)C)NC(=O)C2C3C=CC(C2C(=O)O)O3

InChI

InChI=1S/C18H21NO4/c1-3-12(11-6-4-10(2)5-7-11)19-17(20)15-13-8-9-14(23-13)16(15)18(21)22/h4-9,12-16H,3H2,1-2H3,(H,19,20)(H,21,22)