6-nitro-3-[(E)-3-(6-nitro-1,3-benzodioxol-5-yl)prop-2-enoyl]-4-phenyl-1H-quinolin-2-one

Systemtic Name: 6-nitro-3-[(E)-3-(6-nitro-1,3-benzodioxol-5-yl)prop-2-enoyl]-4-phenyl-1H-quinolin-2-one Openeye Name: 6-nitro-3-[(E)-3-(6-nitro-1,3-benzodioxol-5-yl)prop-2-enoyl]-4-phenyl-1H-quinolin-2-one CAS Name: 6-nitro-3-[(E)-3-(6-nitro-1,3-benzodioxol-5-yl)-1-oxoprop-2-enyl]-4-phenyl-1H-quinolin-2-one IUPAC Name: 6-nitro-3-[(E)-3-(6-nitro-1,3-benzodioxol-5-yl)prop-2-enoyl]-4-phenyl-1H-quinolin-2-one Traditional Name: 6-nitro-3-[(E)-3-(6-nitro-1,3-benzodioxol-5-yl)acryloyl]-4-phenyl-carbostyril Formula: C25H15N3O8 MolecularWeight: 485.4019

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C(=C2)C=CC(=O)C3=C(C4=C(C=CC(=C4)[N+](=O)[O-])NC3=O)C5=CC=CC=C5)[N+](=O)[O-]

Isomeric SMILES

C1OC2=C(O1)C=C(C(=C2)/C=C/C(=O)C3=C(C4=C(C=CC(=C4)[N+](=O)[O-])NC3=O)C5=CC=CC=C5)[N+](=O)[O-]

InChI

InChI=1S/C25H15N3O8/c29-20(9-6-15-10-21-22(36-13-35-21)12-19(15)28(33)34)24-23(14-4-2-1-3-5-14)17-11-16(27(31)32)7-8-18(17)26-25(24)30/h1-12H,13H2,(H,26,30)/b9-6+