heptyl (2Z)-2-[(2-nitrophenyl)methylidene]-3-oxidanylidene-butanoate

Systemtic Name: heptyl (2Z)-2-[(2-nitrophenyl)methylidene]-3-oxidanylidene-butanoate Openeye Name: heptyl (2Z)-2-[(2-nitrophenyl)methylene]-3-oxo-butanoate CAS Name: (2Z)-2-[(2-nitrophenyl)methylidene]-3-oxobutanoic acid heptyl ester IUPAC Name: heptyl (2Z)-2-[(2-nitrophenyl)methylidene]-3-oxobutanoate Traditional Name: (Z)-2-acetyl-3-(2-nitrophenyl)acrylic acid heptyl ester Formula: C18H23NO5 MolecularWeight: 333.37892

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC(=O)C(=CC1=CC=CC=C1[N+](=O)[O-])C(=O)C

Isomeric SMILES

CCCCCCCOC(=O)/C(=C\C1=CC=CC=C1[N+](=O)[O-])/C(=O)C

InChI

InChI=1S/C18H23NO5/c1-3-4-5-6-9-12-24-18(21)16(14(2)20)13-15-10-7-8-11-17(15)19(22)23/h7-8,10-11,13H,3-6,9,12H2,1-2H3/b16-13-