(5S)-N-(4-bromanyl-2-methyl-phenyl)-5-methyl-4,5,6,7-tetrahydro-1,2-benzoxazole-3-carboxamide

Systemtic Name: (5S)-N-(4-bromanyl-2-methyl-phenyl)-5-methyl-4,5,6,7-tetrahydro-1,2-benzoxazole-3-carboxamide Openeye Name: (5S)-N-(4-bromo-2-methyl-phenyl)-5-methyl-4,5,6,7-tetrahydro-1,2-benzoxazole-3-carboxamide CAS Name: (5S)-N-(4-bromo-2-methylphenyl)-5-methyl-4,5,6,7-tetrahydro-1,2-benzoxazole-3-carboxamide IUPAC Name: (5S)-N-(4-bromo-2-methylphenyl)-5-methyl-4,5,6,7-tetrahydro-1,2-benzoxazole-3-carboxamide Traditional Name: (5S)-N-(4-bromo-2-methyl-phenyl)-5-methyl-4,5,6,7-tetrahydroindoxazene-3-carboxamide Formula: C16H17BrN2O2 MolecularWeight: 349.22238

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)C(=NO2)C(=O)NC3=C(C=C(C=C3)Br)C

Isomeric SMILES

C[C@H]1CCC2=C(C1)C(=NO2)C(=O)NC3=C(C=C(C=C3)Br)C

InChI

InChI=1S/C16H17BrN2O2/c1-9-3-6-14-12(7-9)15(19-21-14)16(20)18-13-5-4-11(17)8-10(13)2/h4-5,8-9H,3,6-7H2,1-2H3,(H,18,20)/t9-/m0/s1