[(2S)-1-[(2-methoxydibenzofuran-3-yl)amino]-1-oxidanylidene-propan-2-yl] 6-oxidanylidene-1-(phenylmethyl)pyridazine-3-carboxylate

Systemtic Name: [(2S)-1-[(2-methoxydibenzofuran-3-yl)amino]-1-oxidanylidene-propan-2-yl] 6-oxidanylidene-1-(phenylmethyl)pyridazine-3-carboxylate Openeye Name: [(1S)-2-[(2-methoxydibenzofuran-3-yl)amino]-1-methyl-2-oxo-ethyl] 1-benzyl-6-oxo-pyridazine-3-carboxylate CAS Name: 6-oxo-1-(phenylmethyl)-3-pyridazinecarboxylic acid [(2S)-1-[(2-methoxy-3-dibenzofuranyl)amino]-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-[(2-methoxydibenzofuran-3-yl)amino]-1-oxopropan-2-yl] 1-benzyl-6-oxopyridazine-3-carboxylate Traditional Name: 1-benzyl-6-keto-pyridazine-3-carboxylic acid [(1S)-2-keto-2-[(2-methoxydibenzofuran-3-yl)amino]-1-methyl-ethyl] ester Formula: C28H23N3O6 MolecularWeight: 497.49872

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=C2C3=CC=CC=C3OC2=C1)OC)OC(=O)C4=NN(C(=O)C=C4)CC5=CC=CC=C5

Isomeric SMILES

C[C@@H](C(=O)NC1=C(C=C2C3=CC=CC=C3OC2=C1)OC)OC(=O)C4=NN(C(=O)C=C4)CC5=CC=CC=C5

InChI

InChI=1S/C28H23N3O6/c1-17(36-28(34)21-12-13-26(32)31(30-21)16-18-8-4-3-5-9-18)27(33)29-22-15-24-20(14-25(22)35-2)19-10-6-7-11-23(19)37-24/h3-15,17H,16H2,1-2H3,(H,29,33)/t17-/m0/s1