(phenylmethyl) 7-azanyl-5-(2-bromanyl-1-oxidanyl-ethyl)-2,3-dihydroindole-1-carboxylate

Systemtic Name: (phenylmethyl) 7-azanyl-5-(2-bromanyl-1-oxidanyl-ethyl)-2,3-dihydroindole-1-carboxylate Openeye Name: benzyl 7-amino-5-(2-bromo-1-hydroxy-ethyl)indoline-1-carboxylate CAS Name: 7-amino-5-(2-bromo-1-hydroxyethyl)-2,3-dihydroindole-1-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 7-amino-5-(2-bromo-1-hydroxyethyl)-2,3-dihydroindole-1-carboxylate Traditional Name: 7-amino-5-(2-bromo-1-hydroxy-ethyl)indoline-1-carboxylic acid benzyl ester Formula: C18H19BrN2O3 MolecularWeight: 391.25906

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C2=C(C=C(C=C21)C(CBr)O)N)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

C1CN(C2=C(C=C(C=C21)C(CBr)O)N)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C18H19BrN2O3/c19-10-16(22)14-8-13-6-7-21(17(13)15(20)9-14)18(23)24-11-12-4-2-1-3-5-12/h1-5,8-9,16,22H,6-7,10-11,20H2