4-azanyl-N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-3-nitro-benzamide

Systemtic Name: 4-azanyl-N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-3-nitro-benzamide Openeye Name: 4-amino-N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-3-nitro-benzamide CAS Name: 4-amino-N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-3-nitrobenzamide IUPAC Name: 4-amino-N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-3-nitrobenzamide Traditional Name: 4-amino-N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-3-nitro-benzamide Formula: C16H15N3O5 MolecularWeight: 329.3074

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)CNC(=O)C3=CC(=C(C=C3)N)[N+](=O)[O-]

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)CNC(=O)C3=CC(=C(C=C3)N)[N+](=O)[O-]

InChI

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