3-(1,3-benzodioxol-5-yl)-6-nitro-1-prop-2-enyl-imidazo[4,5-b]pyridin-2-one

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-6-nitro-1-prop-2-enyl-imidazo[4,5-b]pyridin-2-one Openeye Name: 1-allyl-3-(1,3-benzodioxol-5-yl)-6-nitro-imidazo[4,5-b]pyridin-2-one CAS Name: 3-(1,3-benzodioxol-5-yl)-6-nitro-1-prop-2-enyl-2-imidazo[4,5-b]pyridinone IUPAC Name: 3-(1,3-benzodioxol-5-yl)-6-nitro-1-prop-2-enylimidazo[4,5-b]pyridin-2-one Traditional Name: 1-allyl-3-(1,3-benzodioxol-5-yl)-6-nitro-imidazo[4,5-b]pyridin-2-one Formula: C16H12N4O5 MolecularWeight: 340.29028

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C2=CC(=CN=C2N(C1=O)C3=CC4=C(C=C3)OCO4)[N+](=O)[O-]

Isomeric SMILES

C=CCN1C2=CC(=CN=C2N(C1=O)C3=CC4=C(C=C3)OCO4)[N+](=O)[O-]

InChI

InChI=1S/C16H12N4O5/c1-2-5-18-12-6-11(20(22)23)8-17-15(12)19(16(18)21)10-3-4-13-14(7-10)25-9-24-13/h2-4,6-8H,1,5,9H2