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

Systemtic Name: 6-[[(1-butylbenzimidazol-2-yl)amino]methylidene]-4-nitro-cyclohexa-2,4-dien-1-one Openeye Name: 6-[[(1-butylbenzimidazol-2-yl)amino]methylene]-4-nitro-cyclohexa-2,4-dien-1-one CAS Name: 6-[[(1-butyl-2-benzimidazolyl)amino]methylidene]-4-nitro-1-cyclohexa-2,4-dienone IUPAC Name: 6-[[(1-butylbenzimidazol-2-yl)amino]methylidene]-4-nitrocyclohexa-2,4-dien-1-one Traditional Name: 6-[[(1-butylbenzimidazol-2-yl)amino]methylene]-4-nitro-cyclohexa-2,4-dien-1-one Formula: C18H18N4O3 MolecularWeight: 338.36052

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=CC=CC=C2N=C1NC=C3C=C(C=CC3=O)[N+](=O)[O-]

Isomeric SMILES

CCCCN1C2=CC=CC=C2N=C1NC=C3C=C(C=CC3=O)[N+](=O)[O-]

InChI

InChI=1S/C18H18N4O3/c1-2-3-10-21-16-7-5-4-6-15(16)20-18(21)19-12-13-11-14(22(24)25)8-9-17(13)23/h4-9,11-12H,2-3,10H2,1H3,(H,19,20)