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

Systemtic Name: methyl 3-[5-methyl-3-[2-[(2-methylpropan-2-yl)oxycarbonylamino]ethyl]-6-oxidanylidene-cyclohexa-1,4-dien-1-yl]propanoate Openeye Name: methyl 3-[3-[2-(tert-butoxycarbonylamino)ethyl]-5-methyl-6-oxo-cyclohexa-1,4-dien-1-yl]propanoate CAS Name: 3-[5-methyl-3-[2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]ethyl]-6-oxo-1-cyclohexa-1,4-dienyl]propanoic acid methyl ester IUPAC Name: methyl 3-[5-methyl-3-[2-[(2-methylpropan-2-yl)oxycarbonylamino]ethyl]-6-oxocyclohexa-1,4-dien-1-yl]propanoate Traditional Name: 3-[3-[2-(tert-butoxycarbonylamino)ethyl]-6-keto-5-methyl-cyclohexa-1,4-dien-1-yl]propionic acid methyl ester Formula: C18H27NO5 MolecularWeight: 337.41068

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(C=C(C1=O)CCC(=O)OC)CCNC(=O)OC(C)(C)C

Isomeric SMILES

CC1=CC(C=C(C1=O)CCC(=O)OC)CCNC(=O)OC(C)(C)C

InChI

InChI=1S/C18H27NO5/c1-12-10-13(8-9-19-17(22)24-18(2,3)4)11-14(16(12)21)6-7-15(20)23-5/h10-11,13H,6-9H2,1-5H3,(H,19,22)