4-bromanyl-N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methyl-propyl]-3-nitro-benzamide

Systemtic Name: 4-bromanyl-N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methyl-propyl]-3-nitro-benzamide Openeye Name: 4-bromo-N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methyl-propyl]-3-nitro-benzamide CAS Name: 4-bromo-N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methylpropyl]-3-nitrobenzamide IUPAC Name: 4-bromo-N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methylpropyl]-3-nitrobenzamide Traditional Name: 4-bromo-N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methyl-propyl]-3-nitro-benzamide Formula: C19H19BrN2O5 MolecularWeight: 435.26856

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C1=CC2=C(C=C1)OCCO2)NC(=O)C3=CC(=C(C=C3)Br)[N+](=O)[O-]

Isomeric SMILES

CC(C)C(C1=CC2=C(C=C1)OCCO2)NC(=O)C3=CC(=C(C=C3)Br)[N+](=O)[O-]

InChI

InChI=1S/C19H19BrN2O5/c1-11(2)18(12-4-6-16-17(10-12)27-8-7-26-16)21-19(23)13-3-5-14(20)15(9-13)22(24)25/h3-6,9-11,18H,7-8H2,1-2H3,(H,21,23)