(6Z)-6-(azanylmethylidene)-4-hexyl-3-oxidanyl-cyclohexa-2,4-dien-1-one; N-methylbenzamide

Systemtic Name: (6Z)-6-(azanylmethylidene)-4-hexyl-3-oxidanyl-cyclohexa-2,4-dien-1-one; N-methylbenzamide Openeye Name: (6Z)-6-(aminomethylene)-4-hexyl-3-hydroxy-cyclohexa-2,4-dien-1-one; N-methylbenzamide CAS Name: (6Z)-6-(aminomethylidene)-4-hexyl-3-hydroxy-1-cyclohexa-2,4-dienone; N-methylbenzamide IUPAC Name: (6Z)-6-(aminomethylidene)-4-hexyl-3-hydroxycyclohexa-2,4-dien-1-one; N-methylbenzamide Traditional Name: (6Z)-6-(aminomethylene)-4-hexyl-3-hydroxy-cyclohexa-2,4-dien-1-one; N-methylbenzamide Formula: C21H28N2O3 MolecularWeight: 356.45862

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC(=CN)C(=O)C=C1O.CNC(=O)C1=CC=CC=C1

Isomeric SMILES

CCCCCCC1=C/C(=C/N)/C(=O)C=C1O.CNC(=O)C1=CC=CC=C1

InChI

InChI=1S/C13H19NO2.C8H9NO/c1-2-3-4-5-6-10-7-11(9-14)13(16)8-12(10)15;1-9-8(10)7-5-3-2-4-6-7/h7-9,15H,2-6,14H2,1H3;2-6H,1H3,(H,9,10)/b11-9-;