methyl 5-[(4-methylphenyl)carbonylamino]-6-oxidanylidene-heptanoate

Systemtic Name: methyl 5-[(4-methylphenyl)carbonylamino]-6-oxidanylidene-heptanoate Openeye Name: methyl 5-[(4-methylbenzoyl)amino]-6-oxo-heptanoate CAS Name: 5-[[(4-methylphenyl)-oxomethyl]amino]-6-oxoheptanoic acid methyl ester IUPAC Name: methyl 5-[(4-methylbenzoyl)amino]-6-oxoheptanoate Traditional Name: 6-keto-5-(p-toluoylamino)enanthic acid methyl ester Formula: C16H21NO4 MolecularWeight: 291.34224

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NC(CCCC(=O)OC)C(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NC(CCCC(=O)OC)C(=O)C

InChI

InChI=1S/C16H21NO4/c1-11-7-9-13(10-8-11)16(20)17-14(12(2)18)5-4-6-15(19)21-3/h7-10,14H,4-6H2,1-3H3,(H,17,20)