4-[[(1R)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]amino]-3-nitro-benzamide

Systemtic Name: 4-[[(1R)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]amino]-3-nitro-benzamide Openeye Name: 4-[[(1R)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]amino]-3-nitro-benzamide CAS Name: 4-[[(1R)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]amino]-3-nitrobenzamide IUPAC Name: 4-[[(1R)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]amino]-3-nitrobenzamide Traditional Name: 4-[[(1R)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]amino]-3-nitro-benzamide Formula: C17H17N3O5 MolecularWeight: 343.33398

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(C=C1)OCCO2)NC3=C(C=C(C=C3)C(=O)N)[N+](=O)[O-]

Isomeric SMILES

C[C@H](C1=CC2=C(C=C1)OCCO2)NC3=C(C=C(C=C3)C(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C17H17N3O5/c1-10(11-3-5-15-16(9-11)25-7-6-24-15)19-13-4-2-12(17(18)21)8-14(13)20(22)23/h2-5,8-10,19H,6-7H2,1H3,(H2,18,21)/t10-/m1/s1