butyl 4-[[2-[(2-fluorophenyl)carbonylamino]-3-phenyl-propanoyl]amino]benzoate

Systemtic Name: butyl 4-[[2-[(2-fluorophenyl)carbonylamino]-3-phenyl-propanoyl]amino]benzoate Openeye Name: butyl 4-[[2-[(2-fluorobenzoyl)amino]-3-phenyl-propanoyl]amino]benzoate CAS Name: 4-[[2-[[(2-fluorophenyl)-oxomethyl]amino]-1-oxo-3-phenylpropyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[[2-[(2-fluorobenzoyl)amino]-3-phenylpropanoyl]amino]benzoate Traditional Name: 4-[[2-[(2-fluorobenzoyl)amino]-3-phenyl-propanoyl]amino]benzoic acid butyl ester Formula: C27H27FN2O4 MolecularWeight: 462.512683

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)C(CC2=CC=CC=C2)NC(=O)C3=CC=CC=C3F

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)C(CC2=CC=CC=C2)NC(=O)C3=CC=CC=C3F

InChI

InChI=1S/C27H27FN2O4/c1-2-3-17-34-27(33)20-13-15-21(16-14-20)29-26(32)24(18-19-9-5-4-6-10-19)30-25(31)22-11-7-8-12-23(22)28/h4-16,24H,2-3,17-18H2,1H3,(H,29,32)(H,30,31)