ethyl 5-(2-ethoxy-2-oxidanylidene-ethyl)-2-methyl-1-phenyl-pyrrole-3-carboxylate

Systemtic Name: ethyl 5-(2-ethoxy-2-oxidanylidene-ethyl)-2-methyl-1-phenyl-pyrrole-3-carboxylate Openeye Name: ethyl 5-(2-ethoxy-2-oxo-ethyl)-2-methyl-1-phenyl-pyrrole-3-carboxylate CAS Name: 5-(2-ethoxy-2-oxoethyl)-2-methyl-1-phenyl-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-(2-ethoxy-2-oxoethyl)-2-methyl-1-phenylpyrrole-3-carboxylate Traditional Name: 5-(2-ethoxy-2-keto-ethyl)-2-methyl-1-phenyl-pyrrole-3-carboxylic acid ethyl ester Formula: C18H21NO4 MolecularWeight: 315.36364

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=CC(=C(N1C2=CC=CC=C2)C)C(=O)OCC

Isomeric SMILES

CCOC(=O)CC1=CC(=C(N1C2=CC=CC=C2)C)C(=O)OCC

InChI

InChI=1S/C18H21NO4/c1-4-22-17(20)12-15-11-16(18(21)23-5-2)13(3)19(15)14-9-7-6-8-10-14/h6-11H,4-5,12H2,1-3H3