ethyl 5-(2-ethoxy-2-oxidanylidene-ethyl)-4-(phenylmethoxymethyl)-1-(phenylmethyl)pyrrole-3-carboxylate

Systemtic Name: ethyl 5-(2-ethoxy-2-oxidanylidene-ethyl)-4-(phenylmethoxymethyl)-1-(phenylmethyl)pyrrole-3-carboxylate Openeye Name: ethyl 1-benzyl-4-(benzyloxymethyl)-5-(2-ethoxy-2-oxo-ethyl)pyrrole-3-carboxylate CAS Name: 5-(2-ethoxy-2-oxoethyl)-4-(phenylmethoxymethyl)-1-(phenylmethyl)-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-benzyl-5-(2-ethoxy-2-oxoethyl)-4-(phenylmethoxymethyl)pyrrole-3-carboxylate Traditional Name: 4-(benzoxymethyl)-1-benzyl-5-(2-ethoxy-2-keto-ethyl)pyrrole-3-carboxylic acid ethyl ester Formula: C26H29NO5 MolecularWeight: 435.51216

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=C(C(=CN1CC2=CC=CC=C2)C(=O)OCC)COCC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)CC1=C(C(=CN1CC2=CC=CC=C2)C(=O)OCC)COCC3=CC=CC=C3

InChI

InChI=1S/C26H29NO5/c1-3-31-25(28)15-24-23(19-30-18-21-13-9-6-10-14-21)22(26(29)32-4-2)17-27(24)16-20-11-7-5-8-12-20/h5-14,17H,3-4,15-16,18-19H2,1-2H3