methyl 4-(2-methoxy-2-oxidanylidene-ethyl)-5-oxidanylidene-2-phenyl-1-(phenylmethyl)-2H-pyrrole-3-carboxylate

Systemtic Name: methyl 4-(2-methoxy-2-oxidanylidene-ethyl)-5-oxidanylidene-2-phenyl-1-(phenylmethyl)-2H-pyrrole-3-carboxylate Openeye Name: methyl 1-benzyl-4-(2-methoxy-2-oxo-ethyl)-5-oxo-2-phenyl-2H-pyrrole-3-carboxylate CAS Name: 4-(2-methoxy-2-oxoethyl)-5-oxo-2-phenyl-1-(phenylmethyl)-2H-pyrrole-3-carboxylic acid methyl ester IUPAC Name: methyl 1-benzyl-4-(2-methoxy-2-oxoethyl)-5-oxo-2-phenyl-2H-pyrrole-3-carboxylate Traditional Name: 1-benzyl-5-keto-4-(2-keto-2-methoxy-ethyl)-2-phenyl-3-pyrroline-3-carboxylic acid methyl ester Formula: C22H21NO5 MolecularWeight: 379.40584

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1=C(C(N(C1=O)CC2=CC=CC=C2)C3=CC=CC=C3)C(=O)OC

Isomeric SMILES

COC(=O)CC1=C(C(N(C1=O)CC2=CC=CC=C2)C3=CC=CC=C3)C(=O)OC

InChI

InChI=1S/C22H21NO5/c1-27-18(24)13-17-19(22(26)28-2)20(16-11-7-4-8-12-16)23(21(17)25)14-15-9-5-3-6-10-15/h3-12,20H,13-14H2,1-2H3