ethyl 2-methyl-5-oxidanyl-4-oxidanylidene-1,5-bis(phenylmethyl)pyrrole-3-carboxylate

Systemtic Name: ethyl 2-methyl-5-oxidanyl-4-oxidanylidene-1,5-bis(phenylmethyl)pyrrole-3-carboxylate Openeye Name: ethyl 1,5-dibenzyl-5-hydroxy-2-methyl-4-oxo-pyrrole-3-carboxylate CAS Name: 5-hydroxy-2-methyl-4-oxo-1,5-bis(phenylmethyl)-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 1,5-dibenzyl-5-hydroxy-2-methyl-4-oxopyrrole-3-carboxylate Traditional Name: 1,5-dibenzyl-5-hydroxy-4-keto-2-methyl-2-pyrroline-3-carboxylic acid ethyl ester Formula: C22H23NO4 MolecularWeight: 365.42232

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(C1=O)(CC2=CC=CC=C2)O)CC3=CC=CC=C3)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(C1=O)(CC2=CC=CC=C2)O)CC3=CC=CC=C3)C

InChI

InChI=1S/C22H23NO4/c1-3-27-21(25)19-16(2)23(15-18-12-8-5-9-13-18)22(26,20(19)24)14-17-10-6-4-7-11-17/h4-13,26H,3,14-15H2,1-2H3