6-nitro-4-phenyl-3-[(E)-3-quinolin-6-ylprop-2-enoyl]-1H-quinolin-2-one

Systemtic Name: 6-nitro-4-phenyl-3-[(E)-3-quinolin-6-ylprop-2-enoyl]-1H-quinolin-2-one Openeye Name: 6-nitro-4-phenyl-3-[(E)-3-(6-quinolyl)prop-2-enoyl]-1H-quinolin-2-one CAS Name: 6-nitro-3-[(E)-1-oxo-3-(6-quinolinyl)prop-2-enyl]-4-phenyl-1H-quinolin-2-one IUPAC Name: 6-nitro-4-phenyl-3-[(E)-3-quinolin-6-ylprop-2-enoyl]-1H-quinolin-2-one Traditional Name: 6-nitro-4-phenyl-3-[(E)-3-(6-quinolyl)acryloyl]carbostyril Formula: C27H17N3O4 MolecularWeight: 447.44158

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(C(=O)NC3=C2C=C(C=C3)[N+](=O)[O-])C(=O)C=CC4=CC5=C(C=C4)N=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)C2=C(C(=O)NC3=C2C=C(C=C3)[N+](=O)[O-])C(=O)/C=C/C4=CC5=C(C=C4)N=CC=C5

InChI

InChI=1S/C27H17N3O4/c31-24(13-9-17-8-11-22-19(15-17)7-4-14-28-22)26-25(18-5-2-1-3-6-18)21-16-20(30(33)34)10-12-23(21)29-27(26)32/h1-16H,(H,29,32)/b13-9+