[2-[(3,5-diaminocarbonylphenyl)amino]-2-oxidanylidene-ethyl] 4-methylpentanoate

Systemtic Name: [2-[(3,5-diaminocarbonylphenyl)amino]-2-oxidanylidene-ethyl] 4-methylpentanoate Openeye Name: [2-(3,5-dicarbamoylanilino)-2-oxo-ethyl] 4-methylpentanoate CAS Name: 4-methylpentanoic acid [2-(3,5-dicarbamoylanilino)-2-oxoethyl] ester IUPAC Name: [2-(3,5-dicarbamoylanilino)-2-oxoethyl] 4-methylpentanoate Traditional Name: 4-methylvaleric acid [2-(3,5-dicarbamoylanilino)-2-keto-ethyl] ester Formula: C16H21N3O5 MolecularWeight: 335.35504

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(=O)OCC(=O)NC1=CC(=CC(=C1)C(=O)N)C(=O)N

Isomeric SMILES

CC(C)CCC(=O)OCC(=O)NC1=CC(=CC(=C1)C(=O)N)C(=O)N

InChI

InChI=1S/C16H21N3O5/c1-9(2)3-4-14(21)24-8-13(20)19-12-6-10(15(17)22)5-11(7-12)16(18)23/h5-7,9H,3-4,8H2,1-2H3,(H2,17,22)(H2,18,23)(H,19,20)