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

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

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2C=NC3=C2C=CC(=C3)NC=C4C=C(C=CC4=O)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=CC=C1N2C=NC3=C2C=CC(=C3)NC=C4C=C(C=CC4=O)[N+](=O)[O-]

InChI

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