O2-methyl O4-(phenylmethyl) (2S,6S)-2,6-dimethyl-7-oxidanylidene-6-[2-(quinoxalin-2-ylcarbonylamino)ethoxy]-1,4-diazabicyclo[3.2.0]heptane-2,4-dicarboxylate

Systemtic Name: O2-methyl O4-(phenylmethyl) (2S,6S)-2,6-dimethyl-7-oxidanylidene-6-[2-(quinoxalin-2-ylcarbonylamino)ethoxy]-1,4-diazabicyclo[3.2.0]heptane-2,4-dicarboxylate Openeye Name: O4-benzyl O2-methyl (2S,6S)-2,6-dimethyl-7-oxo-6-[2-(quinoxaline-2-carbonylamino)ethoxy]-1,4-diazabicyclo[3.2.0]heptane-2,4-dicarboxylate CAS Name: (2S,6S)-2,6-dimethyl-7-oxo-6-[2-[[oxo(2-quinoxalinyl)methyl]amino]ethoxy]-1,4-diazabicyclo[3.2.0]heptane-2,4-dicarboxylic acid O2-methyl ester O4-(phenylmethyl) ester IUPAC Name: 4-O-benzyl 2-O-methyl (2S,6S)-2,6-dimethyl-7-oxo-6-[2-(quinoxaline-2-carbonylamino)ethoxy]-1,4-diazabicyclo[3.2.0]heptane-2,4-dicarboxylate Traditional Name: (2S,6S)-7-keto-2,6-dimethyl-6-[2-(quinoxaline-2-carbonylamino)ethoxy]-1,4-diazabicyclo[3.2.0]heptane-2,4-dicarboxylic acid O4-benzyl ester O2-methyl ester Formula: C28H29N5O7 MolecularWeight: 547.55916

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CN(C2N1C(=O)C2(C)OCCNC(=O)C3=NC4=CC=CC=C4N=C3)C(=O)OCC5=CC=CC=C5)C(=O)OC

Isomeric SMILES

C[C@]1(CN(C2N1C(=O)[C@@]2(C)OCCNC(=O)C3=NC4=CC=CC=C4N=C3)C(=O)OCC5=CC=CC=C5)C(=O)OC

InChI

InChI=1S/C28H29N5O7/c1-27(25(36)38-3)17-32(26(37)39-16-18-9-5-4-6-10-18)23-28(2,24(35)33(23)27)40-14-13-29-22(34)21-15-30-19-11-7-8-12-20(19)31-21/h4-12,15,23H,13-14,16-17H2,1-3H3,(H,29,34)/t23?,27-,28-/m0/s1