(6E)-2-nitro-6-[[(2-oxidanyl-5-propyl-phenyl)amino]methylidene]cyclohexa-2,4-dien-1-one

Systemtic Name: (6E)-2-nitro-6-[[(2-oxidanyl-5-propyl-phenyl)amino]methylidene]cyclohexa-2,4-dien-1-one Openeye Name: (6E)-6-[(2-hydroxy-5-propyl-anilino)methylene]-2-nitro-cyclohexa-2,4-dien-1-one CAS Name: (6E)-6-[(2-hydroxy-5-propylanilino)methylidene]-2-nitro-1-cyclohexa-2,4-dienone IUPAC Name: (6E)-6-[(2-hydroxy-5-propylanilino)methylidene]-2-nitrocyclohexa-2,4-dien-1-one Traditional Name: (6E)-6-[(2-hydroxy-5-propyl-anilino)methylene]-2-nitro-cyclohexa-2,4-dien-1-one Formula: C16H16N2O4 MolecularWeight: 300.30924

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=C(C=C1)O)NC=C2C=CC=C(C2=O)[N+](=O)[O-]

Isomeric SMILES

CCCC1=CC(=C(C=C1)O)N/C=C/2\C=CC=C(C2=O)[N+](=O)[O-]

InChI

InChI=1S/C16H16N2O4/c1-2-4-11-7-8-15(19)13(9-11)17-10-12-5-3-6-14(16(12)20)18(21)22/h3,5-10,17,19H,2,4H2,1H3/b12-10+