2-(3,5-dimethylphenoxy)ethyl 1-(furan-2-ylmethyl)-2,5-dimethyl-pyrrole-3-carboxylate

Systemtic Name: 2-(3,5-dimethylphenoxy)ethyl 1-(furan-2-ylmethyl)-2,5-dimethyl-pyrrole-3-carboxylate Openeye Name: 2-(3,5-dimethylphenoxy)ethyl 1-(2-furylmethyl)-2,5-dimethyl-pyrrole-3-carboxylate CAS Name: 1-(2-furanylmethyl)-2,5-dimethyl-3-pyrrolecarboxylic acid 2-(3,5-dimethylphenoxy)ethyl ester IUPAC Name: 2-(3,5-dimethylphenoxy)ethyl 1-(furan-2-ylmethyl)-2,5-dimethylpyrrole-3-carboxylate Traditional Name: 1-(2-furfuryl)-2,5-dimethyl-pyrrole-3-carboxylic acid 2-(3,5-dimethylphenoxy)ethyl ester Formula: C22H25NO4 MolecularWeight: 367.4382

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OCCOC(=O)C2=C(N(C(=C2)C)CC3=CC=CO3)C)C

Isomeric SMILES

CC1=CC(=CC(=C1)OCCOC(=O)C2=C(N(C(=C2)C)CC3=CC=CO3)C)C

InChI

InChI=1S/C22H25NO4/c1-15-10-16(2)12-20(11-15)26-8-9-27-22(24)21-13-17(3)23(18(21)4)14-19-6-5-7-25-19/h5-7,10-13H,8-9,14H2,1-4H3