3-methylbutyl 4-(propanoylamino)benzoate

Systemtic Name: 3-methylbutyl 4-(propanoylamino)benzoate Openeye Name: isopentyl 4-(propanoylamino)benzoate CAS Name: 4-(1-oxopropylamino)benzoic acid 3-methylbutyl ester IUPAC Name: 3-methylbutyl 4-(propanoylamino)benzoate Traditional Name: 4-propionamidobenzoic acid isoamyl ester Formula: C15H21NO3 MolecularWeight: 263.33214

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC=C(C=C1)C(=O)OCCC(C)C

Isomeric SMILES

CCC(=O)NC1=CC=C(C=C1)C(=O)OCCC(C)C

InChI

InChI=1S/C15H21NO3/c1-4-14(17)16-13-7-5-12(6-8-13)15(18)19-10-9-11(2)3/h5-8,11H,4,9-10H2,1-3H3,(H,16,17)