[2-oxidanylidene-2-[(phenylmethyl)carbamoylamino]ethyl] 4-(2,5-dimethylpyrrol-1-yl)benzoate

Systemtic Name: [2-oxidanylidene-2-[(phenylmethyl)carbamoylamino]ethyl] 4-(2,5-dimethylpyrrol-1-yl)benzoate Openeye Name: [2-(benzylcarbamoylamino)-2-oxo-ethyl] 4-(2,5-dimethylpyrrol-1-yl)benzoate CAS Name: 4-(2,5-dimethyl-1-pyrrolyl)benzoic acid [2-oxo-2-[[oxo-[(phenylmethyl)amino]methyl]amino]ethyl] ester IUPAC Name: [2-(benzylcarbamoylamino)-2-oxoethyl] 4-(2,5-dimethylpyrrol-1-yl)benzoate Traditional Name: 4-(2,5-dimethylpyrrol-1-yl)benzoic acid [2-(benzylcarbamoylamino)-2-keto-ethyl] ester Formula: C23H23N3O4 MolecularWeight: 405.44642

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(N1C2=CC=C(C=C2)C(=O)OCC(=O)NC(=O)NCC3=CC=CC=C3)C

Isomeric SMILES

CC1=CC=C(N1C2=CC=C(C=C2)C(=O)OCC(=O)NC(=O)NCC3=CC=CC=C3)C

InChI

InChI=1S/C23H23N3O4/c1-16-8-9-17(2)26(16)20-12-10-19(11-13-20)22(28)30-15-21(27)25-23(29)24-14-18-6-4-3-5-7-18/h3-13H,14-15H2,1-2H3,(H2,24,25,27,29)