[2-(hydroxymethyl)-2-propyl-pentyl]carbamoyl benzoate

Systemtic Name: [2-(hydroxymethyl)-2-propyl-pentyl]carbamoyl benzoate Openeye Name: [2-(hydroxymethyl)-2-propyl-pentyl]carbamoyl benzoate CAS Name: benzoic acid [[[2-(hydroxymethyl)-2-propylpentyl]amino]-oxomethyl] ester IUPAC Name: [2-(hydroxymethyl)-2-propylpentyl]carbamoyl benzoate Traditional Name: benzoic acid (2-methylol-2-propyl-pentyl)carbamoyl ester Formula: C17H25NO4 MolecularWeight: 307.3847

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCC)(CNC(=O)OC(=O)C1=CC=CC=C1)CO

Isomeric SMILES

CCCC(CCC)(CNC(=O)OC(=O)C1=CC=CC=C1)CO

InChI

InChI=1S/C17H25NO4/c1-3-10-17(13-19,11-4-2)12-18-16(21)22-15(20)14-8-6-5-7-9-14/h5-9,19H,3-4,10-13H2,1-2H3,(H,18,21)