(E)-N-(6-chloranylquinolin-8-yl)-3-(6-nitro-1,3-benzodioxol-5-yl)prop-2-enamide

Systemtic Name: (E)-N-(6-chloranylquinolin-8-yl)-3-(6-nitro-1,3-benzodioxol-5-yl)prop-2-enamide Openeye Name: (E)-N-(6-chloro-8-quinolyl)-3-(6-nitro-1,3-benzodioxol-5-yl)prop-2-enamide CAS Name: (E)-N-(6-chloro-8-quinolinyl)-3-(6-nitro-1,3-benzodioxol-5-yl)-2-propenamide IUPAC Name: (E)-N-(6-chloroquinolin-8-yl)-3-(6-nitro-1,3-benzodioxol-5-yl)prop-2-enamide Traditional Name: (E)-N-(6-chloro-8-quinolyl)-3-(6-nitro-1,3-benzodioxol-5-yl)acrylamide Formula: C19H12ClN3O5 MolecularWeight: 397.76868

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C(=C2)C=CC(=O)NC3=C4C(=CC(=C3)Cl)C=CC=N4)[N+](=O)[O-]

Isomeric SMILES

C1OC2=C(O1)C=C(C(=C2)/C=C/C(=O)NC3=C4C(=CC(=C3)Cl)C=CC=N4)[N+](=O)[O-]

InChI

InChI=1S/C19H12ClN3O5/c20-13-6-12-2-1-5-21-19(12)14(8-13)22-18(24)4-3-11-7-16-17(28-10-27-16)9-15(11)23(25)26/h1-9H,10H2,(H,22,24)/b4-3+