(3S)-N-(4-bromanyl-2-methyl-phenyl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide

Systemtic Name: (3S)-N-(4-bromanyl-2-methyl-phenyl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide Openeye Name: (3S)-N-(4-bromo-2-methyl-phenyl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide CAS Name: (3S)-N-(4-bromo-2-methylphenyl)-2,3-dihydro-1,4-benzodioxin-3-carboxamide IUPAC Name: (3S)-N-(4-bromo-2-methylphenyl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide Traditional Name: (3S)-N-(4-bromo-2-methyl-phenyl)-2,3-dihydro-1,4-benzodioxin-3-carboxamide Formula: C16H14BrNO3 MolecularWeight: 348.19126

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)NC(=O)C2COC3=CC=CC=C3O2

Isomeric SMILES

CC1=C(C=CC(=C1)Br)NC(=O)[C@@H]2COC3=CC=CC=C3O2

InChI

InChI=1S/C16H14BrNO3/c1-10-8-11(17)6-7-12(10)18-16(19)15-9-20-13-4-2-3-5-14(13)21-15/h2-8,15H,9H2,1H3,(H,18,19)/t15-/m0/s1