(phenylmethyl) 2-[(3-bromanyl-4,5-dihydro-1,2-oxazol-5-yl)methylcarbamoyl]-2,3-dihydroindole-1-carboxylate

Systemtic Name: (phenylmethyl) 2-[(3-bromanyl-4,5-dihydro-1,2-oxazol-5-yl)methylcarbamoyl]-2,3-dihydroindole-1-carboxylate Openeye Name: benzyl 2-[(3-bromo-4,5-dihydroisoxazol-5-yl)methylcarbamoyl]indoline-1-carboxylate CAS Name: 2-[[(3-bromo-4,5-dihydroisoxazol-5-yl)methylamino]-oxomethyl]-2,3-dihydroindole-1-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[(3-bromo-4,5-dihydro-1,2-oxazol-5-yl)methylcarbamoyl]-2,3-dihydroindole-1-carboxylate Traditional Name: 2-[(3-bromo-2-isoxazolin-5-yl)methylcarbamoyl]indoline-1-carboxylic acid benzyl ester Formula: C21H20BrN3O4 MolecularWeight: 458.3052

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Descriptors Computed from Structure

Canonical SMILES:

C1C(ON=C1Br)CNC(=O)C2CC3=CC=CC=C3N2C(=O)OCC4=CC=CC=C4

Isomeric SMILES

C1C(ON=C1Br)CNC(=O)C2CC3=CC=CC=C3N2C(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C21H20BrN3O4/c22-19-11-16(29-24-19)12-23-20(26)18-10-15-8-4-5-9-17(15)25(18)21(27)28-13-14-6-2-1-3-7-14/h1-9,16,18H,10-13H2,(H,23,26)