ethyl 2-[3-[(2-methylpropan-2-yl)oxycarbonylamino]-2-oxidanylidene-4,5-dihydro-3H-azepin-1-yl]ethanoate

Systemtic Name: ethyl 2-[3-[(2-methylpropan-2-yl)oxycarbonylamino]-2-oxidanylidene-4,5-dihydro-3H-azepin-1-yl]ethanoate Openeye Name: ethyl 2-[3-(tert-butoxycarbonylamino)-2-oxo-4,5-dihydro-3H-azepin-1-yl]acetate CAS Name: 2-[3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-2-oxo-4,5-dihydro-3H-azepin-1-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[3-[(2-methylpropan-2-yl)oxycarbonylamino]-2-oxo-4,5-dihydro-3H-azepin-1-yl]acetate Traditional Name: 2-[3-(tert-butoxycarbonylamino)-2-keto-4,5-dihydro-3H-azepin-1-yl]acetic acid ethyl ester Formula: C15H24N2O5 MolecularWeight: 312.36146

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C=CCCC(C1=O)NC(=O)OC(C)(C)C

Isomeric SMILES

CCOC(=O)CN1C=CCCC(C1=O)NC(=O)OC(C)(C)C

InChI

InChI=1S/C15H24N2O5/c1-5-21-12(18)10-17-9-7-6-8-11(13(17)19)16-14(20)22-15(2,3)4/h7,9,11H,5-6,8,10H2,1-4H3,(H,16,20)