ethyl 5-[(3-methoxy-4-propoxy-phenyl)methylcarbamoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl 5-[(3-methoxy-4-propoxy-phenyl)methylcarbamoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate Openeye Name: ethyl 5-[(3-methoxy-4-propoxy-phenyl)methylcarbamoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate CAS Name: 5-[[(3-methoxy-4-propoxyphenyl)methylamino]-oxomethyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 5-[(3-methoxy-4-propoxyphenyl)methylcarbamoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate Traditional Name: 5-[(3-methoxy-4-propoxy-benzyl)carbamoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C21H28N2O5 MolecularWeight: 388.45742

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)CNC(=O)C2=C(C(=C(N2)C)C(=O)OCC)C)OC

Isomeric SMILES

CCCOC1=C(C=C(C=C1)CNC(=O)C2=C(C(=C(N2)C)C(=O)OCC)C)OC

InChI

InChI=1S/C21H28N2O5/c1-6-10-28-16-9-8-15(11-17(16)26-5)12-22-20(24)19-13(3)18(14(4)23-19)21(25)27-7-2/h8-9,11,23H,6-7,10,12H2,1-5H3,(H,22,24)