methyl 2-oxidanylidene-1-[(1R)-2-oxidanyl-1-phenyl-ethyl]-5-(4-phenylmethoxybutyl)-3H-pyrrole-4-carboxylate

Systemtic Name: methyl 2-oxidanylidene-1-[(1R)-2-oxidanyl-1-phenyl-ethyl]-5-(4-phenylmethoxybutyl)-3H-pyrrole-4-carboxylate Openeye Name: methyl 5-(4-benzyloxybutyl)-1-[(1R)-2-hydroxy-1-phenyl-ethyl]-2-oxo-3H-pyrrole-4-carboxylate CAS Name: 1-[(1R)-2-hydroxy-1-phenylethyl]-2-oxo-5-(4-phenylmethoxybutyl)-3H-pyrrole-4-carboxylic acid methyl ester IUPAC Name: methyl 1-[(1R)-2-hydroxy-1-phenylethyl]-2-oxo-5-(4-phenylmethoxybutyl)-3H-pyrrole-4-carboxylate Traditional Name: 2-(4-benzoxybutyl)-1-[(1R)-2-hydroxy-1-phenyl-ethyl]-5-keto-2-pyrroline-3-carboxylic acid methyl ester Formula: C25H29NO5 MolecularWeight: 423.50146

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(N(C(=O)C1)C(CO)C2=CC=CC=C2)CCCCOCC3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=C(N(C(=O)C1)[C@@H](CO)C2=CC=CC=C2)CCCCOCC3=CC=CC=C3

InChI

InChI=1S/C25H29NO5/c1-30-25(29)21-16-24(28)26(23(17-27)20-12-6-3-7-13-20)22(21)14-8-9-15-31-18-19-10-4-2-5-11-19/h2-7,10-13,23,27H,8-9,14-18H2,1H3/t23-/m0/s1