2-[(E)-2-(6-nitro-1,3-benzodioxol-5-yl)ethenyl]-7-prop-2-enyl-quinolin-8-ol

Systemtic Name: 2-[(E)-2-(6-nitro-1,3-benzodioxol-5-yl)ethenyl]-7-prop-2-enyl-quinolin-8-ol Openeye Name: 7-allyl-2-[(E)-2-(6-nitro-1,3-benzodioxol-5-yl)vinyl]quinolin-8-ol CAS Name: 2-[(E)-2-(6-nitro-1,3-benzodioxol-5-yl)ethenyl]-7-prop-2-enyl-8-quinolinol IUPAC Name: 2-[(E)-2-(6-nitro-1,3-benzodioxol-5-yl)ethenyl]-7-prop-2-enylquinolin-8-ol Traditional Name: 7-allyl-2-[(E)-2-(6-nitro-1,3-benzodioxol-5-yl)vinyl]quinolin-8-ol Formula: C21H16N2O5 MolecularWeight: 376.36214

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Descriptors Computed from Structure

Canonical SMILES:

C=CCC1=C(C2=C(C=C1)C=CC(=N2)C=CC3=CC4=C(C=C3[N+](=O)[O-])OCO4)O

Isomeric SMILES

C=CCC1=C(C2=C(C=C1)C=CC(=N2)/C=C/C3=CC4=C(C=C3[N+](=O)[O-])OCO4)O

InChI

InChI=1S/C21H16N2O5/c1-2-3-14-5-4-13-6-8-16(22-20(13)21(14)24)9-7-15-10-18-19(28-12-27-18)11-17(15)23(25)26/h2,4-11,24H,1,3,12H2/b9-7+