methyl 5-[2-[3-(aminocarbonylamino)-3-phenyl-propanoyl]oxyethanoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate

Systemtic Name: methyl 5-[2-[3-(aminocarbonylamino)-3-phenyl-propanoyl]oxyethanoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate Openeye Name: methyl 2,4-dimethyl-5-[2-(3-phenyl-3-ureido-propanoyl)oxyacetyl]-1H-pyrrole-3-carboxylate CAS Name: 5-[2-[3-(carbamoylamino)-1-oxo-3-phenylpropoxy]-1-oxoethyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid methyl ester IUPAC Name: methyl 5-[2-[3-(carbamoylamino)-3-phenylpropanoyl]oxyacetyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate Traditional Name: 2,4-dimethyl-5-[2-(3-phenyl-3-ureido-propanoyl)oxyacetyl]-1H-pyrrole-3-carboxylic acid methyl ester Formula: C20H23N3O6 MolecularWeight: 401.41312

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)OC)C)C(=O)COC(=O)CC(C2=CC=CC=C2)NC(=O)N

Isomeric SMILES

CC1=C(NC(=C1C(=O)OC)C)C(=O)COC(=O)CC(C2=CC=CC=C2)NC(=O)N

InChI

InChI=1S/C20H23N3O6/c1-11-17(19(26)28-3)12(2)22-18(11)15(24)10-29-16(25)9-14(23-20(21)27)13-7-5-4-6-8-13/h4-8,14,22H,9-10H2,1-3H3,(H3,21,23,27)