ethyl 5-[(2S)-2-[(2-methoxy-5-methyl-phenyl)methyl-methyl-amino]propanoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl 5-[(2S)-2-[(2-methoxy-5-methyl-phenyl)methyl-methyl-amino]propanoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate Openeye Name: ethyl 5-[(2S)-2-[(2-methoxy-5-methyl-phenyl)methyl-methyl-amino]propanoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate CAS Name: 5-[(2S)-2-[(2-methoxy-5-methylphenyl)methyl-methylamino]-1-oxopropyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 5-[(2S)-2-[(2-methoxy-5-methylphenyl)methyl-methylamino]propanoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate Traditional Name: 5-[(2S)-2-[(2-methoxy-5-methyl-benzyl)-methyl-amino]propanoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C22H30N2O4 MolecularWeight: 386.4846

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C)C(=O)C(C)N(C)CC2=C(C=CC(=C2)C)OC)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C)C(=O)[C@H](C)N(C)CC2=C(C=CC(=C2)C)OC)C

InChI

InChI=1S/C22H30N2O4/c1-8-28-22(26)19-14(3)20(23-15(19)4)21(25)16(5)24(6)12-17-11-13(2)9-10-18(17)27-7/h9-11,16,23H,8,12H2,1-7H3/t16-/m0/s1