tert-butyl N-[(2S)-5-[(2-bromanyl-3-methyl-phenyl)carbonylamino]-2,3-dihydro-1H-inden-2-yl]carbamate

Systemtic Name: tert-butyl N-[(2S)-5-[(2-bromanyl-3-methyl-phenyl)carbonylamino]-2,3-dihydro-1H-inden-2-yl]carbamate Openeye Name: tert-butyl N-[(2S)-5-[(2-bromo-3-methyl-benzoyl)amino]indan-2-yl]carbamate CAS Name: N-[(2S)-5-[[(2-bromo-3-methylphenyl)-oxomethyl]amino]-2,3-dihydro-1H-inden-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(2S)-5-[(2-bromo-3-methylbenzoyl)amino]-2,3-dihydro-1H-inden-2-yl]carbamate Traditional Name: N-[(2S)-5-[(2-bromo-3-methyl-benzoyl)amino]indan-2-yl]carbamic acid tert-butyl ester Formula: C22H25BrN2O3 MolecularWeight: 445.3495

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1Br)C(=O)NC2=CC3=C(CC(C3)NC(=O)OC(C)(C)C)C=C2

Isomeric SMILES

CC1=CC=CC(=C1Br)C(=O)NC2=CC3=C(C[C@@H](C3)NC(=O)OC(C)(C)C)C=C2

InChI

InChI=1S/C22H25BrN2O3/c1-13-6-5-7-18(19(13)23)20(26)24-16-9-8-14-10-17(12-15(14)11-16)25-21(27)28-22(2,3)4/h5-9,11,17H,10,12H2,1-4H3,(H,24,26)(H,25,27)/t17-/m0/s1