4-azanyl-N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-3-nitro-benzamide

Systemtic Name: 4-azanyl-N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-3-nitro-benzamide Openeye Name: 4-amino-N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-3-nitro-benzamide CAS Name: 4-amino-N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-3-nitrobenzamide IUPAC Name: 4-amino-N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-3-nitrobenzamide Traditional Name: 4-amino-N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-3-nitro-benzamide Formula: C16H15N3O5 MolecularWeight: 329.3074

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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