(2R,3S)-N-(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)-3-methyl-2-phenyl-pentanamide

Systemtic Name: (2R,3S)-N-(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)-3-methyl-2-phenyl-pentanamide Openeye Name: (2R,3S)-N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-3-methyl-2-phenyl-pentanamide CAS Name: (2R,3S)-N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-3-methyl-2-phenylpentanamide IUPAC Name: (2R,3S)-N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-3-methyl-2-phenylpentanamide Traditional Name: (2R,3S)-N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-3-methyl-2-phenyl-valeramide Formula: C20H22BrNO3 MolecularWeight: 404.29758

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C1=CC=CC=C1)C(=O)NC2=CC3=C(C=C2Br)OCCO3

Isomeric SMILES

CC[C@H](C)[C@H](C1=CC=CC=C1)C(=O)NC2=CC3=C(C=C2Br)OCCO3

InChI

InChI=1S/C20H22BrNO3/c1-3-13(2)19(14-7-5-4-6-8-14)20(23)22-16-12-18-17(11-15(16)21)24-9-10-25-18/h4-8,11-13,19H,3,9-10H2,1-2H3,(H,22,23)/t13-,19+/m0/s1