ethyl 3-(5-methyl-6-oxidanylidene-cyclohexa-1,4-dien-1-yl)-3-[2-[(2-methylpropan-2-yl)oxycarbonylamino]ethanoylamino]propanoate

Systemtic Name: ethyl 3-(5-methyl-6-oxidanylidene-cyclohexa-1,4-dien-1-yl)-3-[2-[(2-methylpropan-2-yl)oxycarbonylamino]ethanoylamino]propanoate Openeye Name: ethyl 3-[[2-(tert-butoxycarbonylamino)acetyl]amino]-3-(5-methyl-6-oxo-cyclohexa-1,4-dien-1-yl)propanoate CAS Name: 3-(5-methyl-6-oxo-1-cyclohexa-1,4-dienyl)-3-[[2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-oxoethyl]amino]propanoic acid ethyl ester IUPAC Name: ethyl 3-(5-methyl-6-oxocyclohexa-1,4-dien-1-yl)-3-[[2-[(2-methylpropan-2-yl)oxycarbonylamino]acetyl]amino]propanoate Traditional Name: 3-[[2-(tert-butoxycarbonylamino)acetyl]amino]-3-(6-keto-5-methyl-cyclohexa-1,4-dien-1-yl)propionic acid ethyl ester Formula: C19H28N2O6 MolecularWeight: 380.43542

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(C1=CCC=C(C1=O)C)NC(=O)CNC(=O)OC(C)(C)C

Isomeric SMILES

CCOC(=O)CC(C1=CCC=C(C1=O)C)NC(=O)CNC(=O)OC(C)(C)C

InChI

InChI=1S/C19H28N2O6/c1-6-26-16(23)10-14(13-9-7-8-12(2)17(13)24)21-15(22)11-20-18(25)27-19(3,4)5/h8-9,14H,6-7,10-11H2,1-5H3,(H,20,25)(H,21,22)