(2-oxidanylidene-2-phenylazanyl-ethyl) 2-[(4-fluorophenyl)carbonylamino]-3-(1H-indol-3-yl)propanoate

Systemtic Name: (2-oxidanylidene-2-phenylazanyl-ethyl) 2-[(4-fluorophenyl)carbonylamino]-3-(1H-indol-3-yl)propanoate Openeye Name: (2-anilino-2-oxo-ethyl) 2-[(4-fluorobenzoyl)amino]-3-(1H-indol-3-yl)propanoate CAS Name: 2-[[(4-fluorophenyl)-oxomethyl]amino]-3-(1H-indol-3-yl)propanoic acid (2-anilino-2-oxoethyl) ester IUPAC Name: (2-anilino-2-oxoethyl) 2-[(4-fluorobenzoyl)amino]-3-(1H-indol-3-yl)propanoate Traditional Name: 2-[(4-fluorobenzoyl)amino]-3-(1H-indol-3-yl)propionic acid (2-anilino-2-keto-ethyl) ester Formula: C26H22FN3O4 MolecularWeight: 459.468983

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)COC(=O)C(CC2=CNC3=CC=CC=C32)NC(=O)C4=CC=C(C=C4)F

Isomeric SMILES

C1=CC=C(C=C1)NC(=O)COC(=O)C(CC2=CNC3=CC=CC=C32)NC(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C26H22FN3O4/c27-19-12-10-17(11-13-19)25(32)30-23(14-18-15-28-22-9-5-4-8-21(18)22)26(33)34-16-24(31)29-20-6-2-1-3-7-20/h1-13,15,23,28H,14,16H2,(H,29,31)(H,30,32)