4-[[2-bis(3-methylphenoxy)phosphorylhydrazinyl]methylidene]-3-oxidanyl-cyclohexa-2,5-dien-1-one

Systemtic Name: 4-[[2-bis(3-methylphenoxy)phosphorylhydrazinyl]methylidene]-3-oxidanyl-cyclohexa-2,5-dien-1-one Openeye Name: 4-[[2-bis(3-methylphenoxy)phosphorylhydrazino]methylene]-3-hydroxy-cyclohexa-2,5-dien-1-one CAS Name: 4-[[bis(3-methylphenoxy)phosphorylhydrazo]methylidene]-3-hydroxy-1-cyclohexa-2,5-dienone IUPAC Name: 4-[[2-bis(3-methylphenoxy)phosphorylhydrazinyl]methylidene]-3-hydroxycyclohexa-2,5-dien-1-one Traditional Name: 4-[[N'-bis(3-methylphenoxy)phosphorylhydrazino]methylene]-3-hydroxy-cyclohexa-2,5-dien-1-one Formula: C21H21N2O5P MolecularWeight: 412.375601

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OP(=O)(NNC=C2C=CC(=O)C=C2O)OC3=CC=CC(=C3)C

Isomeric SMILES

CC1=CC(=CC=C1)OP(=O)(NNC=C2C=CC(=O)C=C2O)OC3=CC=CC(=C3)C

InChI

InChI=1S/C21H21N2O5P/c1-15-5-3-7-19(11-15)27-29(26,28-20-8-4-6-16(2)12-20)23-22-14-17-9-10-18(24)13-21(17)25/h3-14,22,25H,1-2H3,(H,23,26)