methyl (3aR)-4-oxidanylidene-5-[(2S)-1-oxidanylidene-1-phenylmethoxy-propan-2-yl]-3a,6-dihydro-3H-pyrazolo[1,5-a][1,4]benzodiazepine-2-carboxylate

Systemtic Name: methyl (3aR)-4-oxidanylidene-5-[(2S)-1-oxidanylidene-1-phenylmethoxy-propan-2-yl]-3a,6-dihydro-3H-pyrazolo[1,5-a][1,4]benzodiazepine-2-carboxylate Openeye Name: methyl (3aR)-5-[(1S)-2-benzyloxy-1-methyl-2-oxo-ethyl]-4-oxo-3a,6-dihydro-3H-pyrazolo[1,5-a][1,4]benzodiazepine-2-carboxylate CAS Name: (3aR)-4-oxo-5-[(2S)-1-oxo-1-phenylmethoxypropan-2-yl]-3a,6-dihydro-3H-pyrazolo[1,5-a][1,4]benzodiazepine-2-carboxylic acid methyl ester IUPAC Name: methyl (3aR)-4-oxo-5-[(2S)-1-oxo-1-phenylmethoxypropan-2-yl]-3a,6-dihydro-3H-pyrazolo[1,5-a][1,4]benzodiazepine-2-carboxylate Traditional Name: (3aR)-5-[(1S)-2-benzoxy-2-keto-1-methyl-ethyl]-4-keto-3a,6-dihydro-3H-pyrazolo[1,5-a][1,4]benzodiazepine-2-carboxylic acid methyl ester Formula: C23H23N3O5 MolecularWeight: 421.44582

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OCC1=CC=CC=C1)N2CC3=CC=CC=C3N4C(C2=O)CC(=N4)C(=O)OC

Isomeric SMILES

C[C@@H](C(=O)OCC1=CC=CC=C1)N2CC3=CC=CC=C3N4[C@@H](C2=O)CC(=N4)C(=O)OC

InChI

InChI=1S/C23H23N3O5/c1-15(22(28)31-14-16-8-4-3-5-9-16)25-13-17-10-6-7-11-19(17)26-20(21(25)27)12-18(24-26)23(29)30-2/h3-11,15,20H,12-14H2,1-2H3/t15-,20+/m0/s1