ethyl 3-[[2-[2-(2-phenylethanoylamino)ethanoyl]pyrazolidin-1-yl]carbonylamino]benzoate

Systemtic Name: ethyl 3-[[2-[2-(2-phenylethanoylamino)ethanoyl]pyrazolidin-1-yl]carbonylamino]benzoate Openeye Name: ethyl 3-[[2-[2-[(2-phenylacetyl)amino]acetyl]pyrazolidine-1-carbonyl]amino]benzoate CAS Name: 3-[[oxo-[2-[1-oxo-2-[(1-oxo-2-phenylethyl)amino]ethyl]-1-pyrazolidinyl]methyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 3-[[2-[2-[(2-phenylacetyl)amino]acetyl]pyrazolidine-1-carbonyl]amino]benzoate Traditional Name: 3-[[2-[2-[(2-phenylacetyl)amino]acetyl]pyrazolidine-1-carbonyl]amino]benzoic acid ethyl ester Formula: C23H26N4O5 MolecularWeight: 438.47634

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC=C1)NC(=O)N2CCCN2C(=O)CNC(=O)CC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=CC(=CC=C1)NC(=O)N2CCCN2C(=O)CNC(=O)CC3=CC=CC=C3

InChI

InChI=1S/C23H26N4O5/c1-2-32-22(30)18-10-6-11-19(15-18)25-23(31)27-13-7-12-26(27)21(29)16-24-20(28)14-17-8-4-3-5-9-17/h3-6,8-11,15H,2,7,12-14,16H2,1H3,(H,24,28)(H,25,31)