ethyl 6-(4-bromophenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-8-oxa-7-azaspiro[3.4]oct-6-ene-2-carboxylate

Systemtic Name: ethyl 6-(4-bromophenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-8-oxa-7-azaspiro[3.4]oct-6-ene-2-carboxylate Openeye Name: ethyl 6-(4-bromophenyl)-2-(tert-butoxycarbonylamino)-8-oxa-7-azaspiro[3.4]oct-6-ene-2-carboxylate CAS Name: 6-(4-bromophenyl)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-8-oxa-7-azaspiro[3.4]oct-6-ene-2-carboxylic acid ethyl ester IUPAC Name: ethyl 6-(4-bromophenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-8-oxa-7-azaspiro[3.4]oct-6-ene-2-carboxylate Traditional Name: 6-(4-bromophenyl)-2-(tert-butoxycarbonylamino)-8-oxa-7-azaspiro[3.4]oct-6-ene-2-carboxylic acid ethyl ester Formula: C20H25BrN2O5 MolecularWeight: 453.3269

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CC2(C1)CC(=NO2)C3=CC=C(C=C3)Br)NC(=O)OC(C)(C)C

Isomeric SMILES

CCOC(=O)C1(CC2(C1)CC(=NO2)C3=CC=C(C=C3)Br)NC(=O)OC(C)(C)C

InChI

InChI=1S/C20H25BrN2O5/c1-5-26-16(24)20(22-17(25)27-18(2,3)4)11-19(12-20)10-15(23-28-19)13-6-8-14(21)9-7-13/h6-9H,5,10-12H2,1-4H3,(H,22,25)