6-[[(2-butan-2-ylphenyl)amino]methylidene]-4-nitro-cyclohexa-2,4-dien-1-one

Systemtic Name: 6-[[(2-butan-2-ylphenyl)amino]methylidene]-4-nitro-cyclohexa-2,4-dien-1-one Openeye Name: 4-nitro-6-[(2-sec-butylanilino)methylene]cyclohexa-2,4-dien-1-one CAS Name: 6-[(2-butan-2-ylanilino)methylidene]-4-nitro-1-cyclohexa-2,4-dienone IUPAC Name: 6-[(2-butan-2-ylanilino)methylidene]-4-nitrocyclohexa-2,4-dien-1-one Traditional Name: 4-nitro-6-[(2-sec-butylanilino)methylene]cyclohexa-2,4-dien-1-one Formula: C17H18N2O3 MolecularWeight: 298.33642

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=CC=C1NC=C2C=C(C=CC2=O)[N+](=O)[O-]

Isomeric SMILES

CCC(C)C1=CC=CC=C1NC=C2C=C(C=CC2=O)[N+](=O)[O-]

InChI

InChI=1S/C17H18N2O3/c1-3-12(2)15-6-4-5-7-16(15)18-11-13-10-14(19(21)22)8-9-17(13)20/h4-12,18H,3H2,1-2H3