methyl 2,4-dimethyl-5-[2-[2-[(phenylmethyl)carbamoylamino]ethanoyloxy]propanoyl]-1H-pyrrole-3-carboxylate

Systemtic Name: methyl 2,4-dimethyl-5-[2-[2-[(phenylmethyl)carbamoylamino]ethanoyloxy]propanoyl]-1H-pyrrole-3-carboxylate Openeye Name: methyl 5-[2-[2-(benzylcarbamoylamino)acetyl]oxypropanoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate CAS Name: 2,4-dimethyl-5-[1-oxo-2-[1-oxo-2-[[oxo-[(phenylmethyl)amino]methyl]amino]ethoxy]propyl]-1H-pyrrole-3-carboxylic acid methyl ester IUPAC Name: methyl 5-[2-[2-(benzylcarbamoylamino)acetyl]oxypropanoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate Traditional Name: 5-[2-[2-(benzylcarbamoylamino)acetyl]oxypropanoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid methyl ester Formula: C21H25N3O6 MolecularWeight: 415.4397

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)OC)C)C(=O)C(C)OC(=O)CNC(=O)NCC2=CC=CC=C2

Isomeric SMILES

CC1=C(NC(=C1C(=O)OC)C)C(=O)C(C)OC(=O)CNC(=O)NCC2=CC=CC=C2

InChI

InChI=1S/C21H25N3O6/c1-12-17(20(27)29-4)13(2)24-18(12)19(26)14(3)30-16(25)11-23-21(28)22-10-15-8-6-5-7-9-15/h5-9,14,24H,10-11H2,1-4H3,(H2,22,23,28)