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

Systemtic Name: 4-[[(3R)-2,3-dihydro-1,4-benzodioxin-3-yl]methylamino]-3-nitro-benzamide Openeye Name: 4-[[(3R)-2,3-dihydro-1,4-benzodioxin-3-yl]methylamino]-3-nitro-benzamide CAS Name: 4-[[(3R)-2,3-dihydro-1,4-benzodioxin-3-yl]methylamino]-3-nitrobenzamide IUPAC Name: 4-[[(3R)-2,3-dihydro-1,4-benzodioxin-3-yl]methylamino]-3-nitrobenzamide Traditional Name: 4-[[(3R)-2,3-dihydro-1,4-benzodioxin-3-yl]methylamino]-3-nitro-benzamide Formula: C16H15N3O5 MolecularWeight: 329.3074

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC2=CC=CC=C2O1)CNC3=C(C=C(C=C3)C(=O)N)[N+](=O)[O-]

Isomeric SMILES

C1[C@H](OC2=CC=CC=C2O1)CNC3=C(C=C(C=C3)C(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C16H15N3O5/c17-16(20)10-5-6-12(13(7-10)19(21)22)18-8-11-9-23-14-3-1-2-4-15(14)24-11/h1-7,11,18H,8-9H2,(H2,17,20)/t11-/m1/s1