[2-(butylcarbamoylamino)-2-oxidanylidene-ethyl] 2,5-dimethyl-1-phenyl-pyrrole-3-carboxylate

Systemtic Name: [2-(butylcarbamoylamino)-2-oxidanylidene-ethyl] 2,5-dimethyl-1-phenyl-pyrrole-3-carboxylate Openeye Name: [2-(butylcarbamoylamino)-2-oxo-ethyl] 2,5-dimethyl-1-phenyl-pyrrole-3-carboxylate CAS Name: 2,5-dimethyl-1-phenyl-3-pyrrolecarboxylic acid [2-[[butylamino(oxo)methyl]amino]-2-oxoethyl] ester IUPAC Name: [2-(butylcarbamoylamino)-2-oxoethyl] 2,5-dimethyl-1-phenylpyrrole-3-carboxylate Traditional Name: 2,5-dimethyl-1-phenyl-pyrrole-3-carboxylic acid [2-(butylcarbamoylamino)-2-keto-ethyl] ester Formula: C20H25N3O4 MolecularWeight: 371.4302

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)NC(=O)COC(=O)C1=C(N(C(=C1)C)C2=CC=CC=C2)C

Isomeric SMILES

CCCCNC(=O)NC(=O)COC(=O)C1=C(N(C(=C1)C)C2=CC=CC=C2)C

InChI

InChI=1S/C20H25N3O4/c1-4-5-11-21-20(26)22-18(24)13-27-19(25)17-12-14(2)23(15(17)3)16-9-7-6-8-10-16/h6-10,12H,4-5,11,13H2,1-3H3,(H2,21,22,24,26)