methyl 2-benzamido-3-oxidanylidene-octanoate

Systemtic Name: methyl 2-benzamido-3-oxidanylidene-octanoate Openeye Name: methyl 2-benzamido-3-oxo-octanoate CAS Name: 2-benzamido-3-oxooctanoic acid methyl ester IUPAC Name: methyl 2-benzamido-3-oxooctanoate Traditional Name: 2-benzamido-3-keto-caprylic acid methyl ester Formula: C16H21NO4 MolecularWeight: 291.34224

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H21NO4/c1-3-4-6-11-13(18)14(16(20)21-2)17-15(19)12-9-7-5-8-10-12/h5,7-10,14H,3-4,6,11H2,1-2H3,(H,17,19)