6-nitro-N-(1-pyridin-3-ylethyl)-2,3-dihydro-1,4-benzodioxine-7-carboxamide

Systemtic Name: 6-nitro-N-(1-pyridin-3-ylethyl)-2,3-dihydro-1,4-benzodioxine-7-carboxamide Openeye Name: 6-nitro-N-[1-(3-pyridyl)ethyl]-2,3-dihydro-1,4-benzodioxine-7-carboxamide CAS Name: 6-nitro-N-[1-(3-pyridinyl)ethyl]-2,3-dihydro-1,4-benzodioxin-7-carboxamide IUPAC Name: 6-nitro-N-(1-pyridin-3-ylethyl)-2,3-dihydro-1,4-benzodioxine-7-carboxamide Traditional Name: 6-nitro-N-[1-(3-pyridyl)ethyl]-2,3-dihydro-1,4-benzodioxin-7-carboxamide Formula: C16H15N3O5 MolecularWeight: 329.3074

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CN=CC=C1)NC(=O)C2=CC3=C(C=C2[N+](=O)[O-])OCCO3

Isomeric SMILES

CC(C1=CN=CC=C1)NC(=O)C2=CC3=C(C=C2[N+](=O)[O-])OCCO3

InChI

InChI=1S/C16H15N3O5/c1-10(11-3-2-4-17-9-11)18-16(20)12-7-14-15(24-6-5-23-14)8-13(12)19(21)22/h2-4,7-10H,5-6H2,1H3,(H,18,20)