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

Systemtic Name: (6Z)-4-nitro-6-[[(1-pentylbenzimidazol-2-yl)amino]methylidene]cyclohexa-2,4-dien-1-one Openeye Name: (6Z)-4-nitro-6-[[(1-pentylbenzimidazol-2-yl)amino]methylene]cyclohexa-2,4-dien-1-one CAS Name: (6Z)-4-nitro-6-[[(1-pentyl-2-benzimidazolyl)amino]methylidene]-1-cyclohexa-2,4-dienone IUPAC Name: (6Z)-4-nitro-6-[[(1-pentylbenzimidazol-2-yl)amino]methylidene]cyclohexa-2,4-dien-1-one Traditional Name: (6Z)-6-[[(1-amylbenzimidazol-2-yl)amino]methylene]-4-nitro-cyclohexa-2,4-dien-1-one Formula: C19H20N4O3 MolecularWeight: 352.3871

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C2=CC=CC=C2N=C1NC=C3C=C(C=CC3=O)[N+](=O)[O-]

Isomeric SMILES

CCCCCN1C2=CC=CC=C2N=C1N/C=C\3/C=C(C=CC3=O)[N+](=O)[O-]

InChI

InChI=1S/C19H20N4O3/c1-2-3-6-11-22-17-8-5-4-7-16(17)21-19(22)20-13-14-12-15(23(25)26)9-10-18(14)24/h4-5,7-10,12-13H,2-3,6,11H2,1H3,(H,20,21)/b14-13-