[2-(heptan-2-ylamino)-2-oxidanylidene-ethyl] 2-acetamido-3-methyl-benzoate

Systemtic Name: [2-(heptan-2-ylamino)-2-oxidanylidene-ethyl] 2-acetamido-3-methyl-benzoate Openeye Name: [2-(1-methylhexylamino)-2-oxo-ethyl] 2-acetamido-3-methyl-benzoate CAS Name: 2-acetamido-3-methylbenzoic acid [2-(heptan-2-ylamino)-2-oxoethyl] ester IUPAC Name: [2-(heptan-2-ylamino)-2-oxoethyl] 2-acetamido-3-methylbenzoate Traditional Name: 2-acetamido-3-methyl-benzoic acid [2-keto-2-(1-methylhexylamino)ethyl] ester Formula: C19H28N2O4 MolecularWeight: 348.43662

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)NC(=O)COC(=O)C1=C(C(=CC=C1)C)NC(=O)C

Isomeric SMILES

CCCCCC(C)NC(=O)COC(=O)C1=C(C(=CC=C1)C)NC(=O)C

InChI

InChI=1S/C19H28N2O4/c1-5-6-7-10-14(3)20-17(23)12-25-19(24)16-11-8-9-13(2)18(16)21-15(4)22/h8-9,11,14H,5-7,10,12H2,1-4H3,(H,20,23)(H,21,22)