methyl (2S)-1-[(4-methoxyphenyl)methyl]-3-methyl-5-oxidanylidene-2-(phenylmethoxymethyl)pyrrole-2-carboxylate

Systemtic Name: methyl (2S)-1-[(4-methoxyphenyl)methyl]-3-methyl-5-oxidanylidene-2-(phenylmethoxymethyl)pyrrole-2-carboxylate Openeye Name: methyl (2S)-2-(benzyloxymethyl)-1-[(4-methoxyphenyl)methyl]-3-methyl-5-oxo-pyrrole-2-carboxylate CAS Name: (2S)-1-[(4-methoxyphenyl)methyl]-3-methyl-5-oxo-2-(phenylmethoxymethyl)-2-pyrrolecarboxylic acid methyl ester IUPAC Name: methyl (2S)-1-[(4-methoxyphenyl)methyl]-3-methyl-5-oxo-2-(phenylmethoxymethyl)pyrrole-2-carboxylate Traditional Name: (2S)-2-(benzoxymethyl)-5-keto-3-methyl-1-p-anisyl-3-pyrroline-2-carboxylic acid methyl ester Formula: C23H25NO5 MolecularWeight: 395.4483

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N(C1(COCC2=CC=CC=C2)C(=O)OC)CC3=CC=C(C=C3)OC

Isomeric SMILES

CC1=CC(=O)N([C@@]1(COCC2=CC=CC=C2)C(=O)OC)CC3=CC=C(C=C3)OC

InChI

InChI=1S/C23H25NO5/c1-17-13-21(25)24(14-18-9-11-20(27-2)12-10-18)23(17,22(26)28-3)16-29-15-19-7-5-4-6-8-19/h4-13H,14-16H2,1-3H3/t23-/m1/s1