6-[[[1-(4-methoxyphenyl)benzimidazol-5-yl]amino]methylidene]-2-nitro-cyclohexa-2,4-dien-1-one

Systemtic Name: 6-[[[1-(4-methoxyphenyl)benzimidazol-5-yl]amino]methylidene]-2-nitro-cyclohexa-2,4-dien-1-one Openeye Name: 6-[[[1-(4-methoxyphenyl)benzimidazol-5-yl]amino]methylene]-2-nitro-cyclohexa-2,4-dien-1-one CAS Name: 6-[[[1-(4-methoxyphenyl)-5-benzimidazolyl]amino]methylidene]-2-nitro-1-cyclohexa-2,4-dienone IUPAC Name: 6-[[[1-(4-methoxyphenyl)benzimidazol-5-yl]amino]methylidene]-2-nitrocyclohexa-2,4-dien-1-one Traditional Name: 6-[[[1-(4-methoxyphenyl)benzimidazol-5-yl]amino]methylene]-2-nitro-cyclohexa-2,4-dien-1-one Formula: C21H16N4O4 MolecularWeight: 388.37614

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C=NC3=C2C=CC(=C3)NC=C4C=CC=C(C4=O)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)N2C=NC3=C2C=CC(=C3)NC=C4C=CC=C(C4=O)[N+](=O)[O-]

InChI

InChI=1S/C21H16N4O4/c1-29-17-8-6-16(7-9-17)24-13-23-18-11-15(5-10-19(18)24)22-12-14-3-2-4-20(21(14)26)25(27)28/h2-13,22H,1H3