(6E)-3-(3-butoxy-2-oxidanyl-propoxy)-6-(6-phenyl-1H-1,3,5-triazin-2-ylidene)cyclohexa-2,4-dien-1-one

Systemtic Name: (6E)-3-(3-butoxy-2-oxidanyl-propoxy)-6-(6-phenyl-1H-1,3,5-triazin-2-ylidene)cyclohexa-2,4-dien-1-one Openeye Name: (6E)-3-(3-butoxy-2-hydroxy-propoxy)-6-(6-phenyl-1H-1,3,5-triazin-2-ylidene)cyclohexa-2,4-dien-1-one CAS Name: (6E)-3-(3-butoxy-2-hydroxypropoxy)-6-(6-phenyl-1H-1,3,5-triazin-2-ylidene)-1-cyclohexa-2,4-dienone IUPAC Name: (6E)-3-(3-butoxy-2-hydroxypropoxy)-6-(6-phenyl-1H-1,3,5-triazin-2-ylidene)cyclohexa-2,4-dien-1-one Traditional Name: (6E)-3-(3-butoxy-2-hydroxy-propoxy)-6-(6-phenyl-1H-s-triazin-2-ylidene)cyclohexa-2,4-dien-1-one Formula: C22H25N3O4 MolecularWeight: 395.4516

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOCC(COC1=CC(=O)C(=C2NC(=NC=N2)C3=CC=CC=C3)C=C1)O

Isomeric SMILES

CCCCOCC(COC1=CC(=O)/C(=C/2\NC(=NC=N2)C3=CC=CC=C3)/C=C1)O

InChI

InChI=1S/C22H25N3O4/c1-2-3-11-28-13-17(26)14-29-18-9-10-19(20(27)12-18)22-24-15-23-21(25-22)16-7-5-4-6-8-16/h4-10,12,15,17,26H,2-3,11,13-14H2,1H3,(H,23,24,25)/b22-19-