O7-butyl O2-tert-butyl 8-oxidanylidene-3-(phenylcarbamoyl)-1-azabicyclo[4.2.0]oct-2-ene-2,7-dicarboxylate

Systemtic Name: O7-butyl O2-tert-butyl 8-oxidanylidene-3-(phenylcarbamoyl)-1-azabicyclo[4.2.0]oct-2-ene-2,7-dicarboxylate Openeye Name: O7-butyl O2-tert-butyl 8-oxo-3-(phenylcarbamoyl)-1-azabicyclo[4.2.0]oct-2-ene-2,7-dicarboxylate CAS Name: 3-[anilino(oxo)methyl]-8-oxo-1-azabicyclo[4.2.0]oct-2-ene-2,7-dicarboxylic acid O7-butyl ester O2-tert-butyl ester IUPAC Name: 7-O-butyl 2-O-tert-butyl 8-oxo-3-(phenylcarbamoyl)-1-azabicyclo[4.2.0]oct-2-ene-2,7-dicarboxylate Traditional Name: 8-keto-3-(phenylcarbamoyl)-1-azabicyclo[4.2.0]oct-2-ene-2,7-dicarboxylic acid O7-butyl ester O2-tert-butyl ester Formula: C24H30N2O6 MolecularWeight: 442.5048

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1C2CCC(=C(N2C1=O)C(=O)OC(C)(C)C)C(=O)NC3=CC=CC=C3

Isomeric SMILES

CCCCOC(=O)C1C2CCC(=C(N2C1=O)C(=O)OC(C)(C)C)C(=O)NC3=CC=CC=C3

InChI

InChI=1S/C24H30N2O6/c1-5-6-14-31-22(29)18-17-13-12-16(20(27)25-15-10-8-7-9-11-15)19(26(17)21(18)28)23(30)32-24(2,3)4/h7-11,17-18H,5-6,12-14H2,1-4H3,(H,25,27)