ethyl 2,4-dimethyl-5-[3-(3-methylphenoxy)propylcarbamoyl]-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl 2,4-dimethyl-5-[3-(3-methylphenoxy)propylcarbamoyl]-1H-pyrrole-3-carboxylate Openeye Name: ethyl 2,4-dimethyl-5-[3-(3-methylphenoxy)propylcarbamoyl]-1H-pyrrole-3-carboxylate CAS Name: 2,4-dimethyl-5-[[3-(3-methylphenoxy)propylamino]-oxomethyl]-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2,4-dimethyl-5-[3-(3-methylphenoxy)propylcarbamoyl]-1H-pyrrole-3-carboxylate Traditional Name: 2,4-dimethyl-5-[3-(3-methylphenoxy)propylcarbamoyl]-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C20H26N2O4 MolecularWeight: 358.43144

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C)C(=O)NCCCOC2=CC=CC(=C2)C)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C)C(=O)NCCCOC2=CC=CC(=C2)C)C

InChI

InChI=1S/C20H26N2O4/c1-5-25-20(24)17-14(3)18(22-15(17)4)19(23)21-10-7-11-26-16-9-6-8-13(2)12-16/h6,8-9,12,22H,5,7,10-11H2,1-4H3,(H,21,23)