5-[[(1R)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]carbamoyl]-2-nitro-phenolate

Systemtic Name: 5-[[(1R)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]carbamoyl]-2-nitro-phenolate Openeye Name: 5-[[(1R)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]carbamoyl]-2-nitro-phenolate CAS Name: 5-[[[(1R)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]amino]-oxomethyl]-2-nitrophenolate IUPAC Name: 5-[[(1R)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]carbamoyl]-2-nitrophenolate Traditional Name: 5-[[(1R)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]carbamoyl]-2-nitro-phenolate Formula: C17H15N2O6- MolecularWeight: 343.3108

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H16N2O6/c1-10(11-3-5-15-16(9-11)25-7-6-24-15)18-17(21)12-2-4-13(19(22)23)14(20)8-12/h2-5,8-10,20H,6-7H2,1H3,(H,18,21)/p-1/t10-/m1/s1