ethyl 3-(2-azanylethanoylamino)-3-(5-methyl-6-oxidanylidene-cyclohexa-1,4-dien-1-yl)propanoate

Systemtic Name: ethyl 3-(2-azanylethanoylamino)-3-(5-methyl-6-oxidanylidene-cyclohexa-1,4-dien-1-yl)propanoate Openeye Name: ethyl 3-[(2-aminoacetyl)amino]-3-(5-methyl-6-oxo-cyclohexa-1,4-dien-1-yl)propanoate CAS Name: 3-[(2-amino-1-oxoethyl)amino]-3-(5-methyl-6-oxo-1-cyclohexa-1,4-dienyl)propanoic acid ethyl ester IUPAC Name: ethyl 3-[(2-aminoacetyl)amino]-3-(5-methyl-6-oxocyclohexa-1,4-dien-1-yl)propanoate Traditional Name: 3-(glycylamino)-3-(6-keto-5-methyl-cyclohexa-1,4-dien-1-yl)propionic acid ethyl ester Formula: C14H20N2O4 MolecularWeight: 280.3196

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(C1=CCC=C(C1=O)C)NC(=O)CN

Isomeric SMILES

CCOC(=O)CC(C1=CCC=C(C1=O)C)NC(=O)CN

InChI

InChI=1S/C14H20N2O4/c1-3-20-13(18)7-11(16-12(17)8-15)10-6-4-5-9(2)14(10)19/h5-6,11H,3-4,7-8,15H2,1-2H3,(H,16,17)