6-[[(3-phenyl-1,2,4-triazol-4-yl)amino]methylidene]-3-propoxy-cyclohexa-2,4-dien-1-one

Systemtic Name: 6-[[(3-phenyl-1,2,4-triazol-4-yl)amino]methylidene]-3-propoxy-cyclohexa-2,4-dien-1-one Openeye Name: 6-[[(3-phenyl-1,2,4-triazol-4-yl)amino]methylene]-3-propoxy-cyclohexa-2,4-dien-1-one CAS Name: 6-[[(3-phenyl-1,2,4-triazol-4-yl)amino]methylidene]-3-propoxy-1-cyclohexa-2,4-dienone IUPAC Name: 6-[[(3-phenyl-1,2,4-triazol-4-yl)amino]methylidene]-3-propoxycyclohexa-2,4-dien-1-one Traditional Name: 6-[[(3-phenyl-1,2,4-triazol-4-yl)amino]methylene]-3-propoxy-cyclohexa-2,4-dien-1-one Formula: C18H18N4O2 MolecularWeight: 322.36112

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC(=O)C(=CNN2C=NN=C2C3=CC=CC=C3)C=C1

Isomeric SMILES

CCCOC1=CC(=O)C(=CNN2C=NN=C2C3=CC=CC=C3)C=C1

InChI

InChI=1S/C18H18N4O2/c1-2-10-24-16-9-8-15(17(23)11-16)12-20-22-13-19-21-18(22)14-6-4-3-5-7-14/h3-9,11-13,20H,2,10H2,1H3