methyl 4-(1-acetamido-2-ethanoyl-3-oxidanylidene-butyl)benzoate

Systemtic Name: methyl 4-(1-acetamido-2-ethanoyl-3-oxidanylidene-butyl)benzoate Openeye Name: methyl 4-(1-acetamido-2-acetyl-3-oxo-butyl)benzoate CAS Name: 4-(1-acetamido-2-acetyl-3-oxobutyl)benzoic acid methyl ester IUPAC Name: methyl 4-(1-acetamido-2-acetyl-3-oxobutyl)benzoate Traditional Name: 4-(1-acetamido-2-acetyl-3-keto-butyl)benzoic acid methyl ester Formula: C16H19NO5 MolecularWeight: 305.32576

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H19NO5/c1-9(18)14(10(2)19)15(17-11(3)20)12-5-7-13(8-6-12)16(21)22-4/h5-8,14-15H,1-4H3,(H,17,20)